CHEBI:88315 - (R)-nefopam hydrochloride

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (R)-nefopam hydrochloride
ChEBI ID CHEBI:88315
ChEBI ASCII Name (R)-nefopam hydrochloride
Definition A hydrochloride obtained by reaction of (R)-nefopam with one equivalent of hydrochloric acid (the racemic salt is an analgesic drug).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C17H20ClNO
Net Charge 0
Average Mass 289.800
Monoisotopic Mass 289.12334
InChI InChI=1S/C17H19NO.ClH/c1-18-11-12-19-17(14-7-3-2-4-8-14)16-10-6-5-9-15(16)13-18;/h2-10,17H,11-13H2,1H3;1H/t17-;/m1./s1
InChIKey CNNVSINJDJNHQK-UNTBIKODSA-N
SMILES Cl.C1N(CCO[C@@H](C=2C1=CC=CC2)C=3C=CC=CC3)C
ChEBI Ontology
Outgoing (R)-nefopam hydrochloride (CHEBI:88315) has part (R)-nefopam(1+) (CHEBI:88325)
(R)-nefopam hydrochloride (CHEBI:88315) is a hydrochloride (CHEBI:36807)
(R)-nefopam hydrochloride (CHEBI:88315) is enantiomer of (S)-nefopam hydrochloride (CHEBI:88314)
Incoming nefopam hydrochloride (CHEBI:88312) has part (R)-nefopam hydrochloride (CHEBI:88315)
(S)-nefopam hydrochloride (CHEBI:88314) is enantiomer of (R)-nefopam hydrochloride (CHEBI:88315)
IUPAC Names
(1R)-5-methyl-1-phenyl-3,4,5,6-tetrahydro-1H-2,5-benzoxazocin-5-ium chloride
(1R)-5-methyl-1-phenyl-3,4,5,6-tetrahydro-1H-2,5-benzoxazocine hydrochloride
Synonym Source
(R)-3,4,5,6-Tetrahydro-5-methyl-1-phenyl-1H-2,5-benzoxazocine hydrochloride ChemIDplus
Registry Numbers Types Sources
28460737 Reaxys Registry Number Reaxys
53625-25-5 CAS Registry Number ChemIDplus
Last Modified
22 October 2015