CHEBI:107327 - 1-(4-methylphenyl)sulfonyl-5-oxo-2-pyrrolidinecarboxylic acid [[amino-(4-nitrophenyl)methylidene]amino] ester

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ChEBI Name 1-(4-methylphenyl)sulfonyl-5-oxo-2-pyrrolidinecarboxylic acid [[amino-(4-nitrophenyl)methylidene]amino] ester
ChEBI ID CHEBI:107327
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C19H18N4O7S
Net Charge 0
Average Mass 446.436
Monoisotopic Mass 446.08962
InChI InChI=1S/C19H18N4O7S/c1-12-2-8-15(9-3-12)31(28,29)22-16(10-11-17(22)24)19(25)30-21-18(20)13-4-6-14(7-5-13)23(26)27/h2-9,16H,10-11H2,1H3,(H2,20,21)
InChIKey GUHSSAKFHUPPEL-UHFFFAOYSA-N
SMILES CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2=O)C(=O)ON=C(C3=CC=C(C=C3)[N+](=O)[O-])N
ChEBI Ontology
Outgoing 1-(4-methylphenyl)sulfonyl-5-oxo-2-pyrrolidinecarboxylic acid [[amino-(4-nitrophenyl)methylidene]amino] ester (CHEBI:107327) is a proline derivative (CHEBI:26273)
Manual Xref Database
LSM-18681 LINCS
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