CHEBI:107364 - 2-[(4,4-dimethyl-2,6-dioxocyclohexyl)methylideneamino]-5-methyl-3-thiophenecarboxylic acid ethyl ester

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ChEBI Name 2-[(4,4-dimethyl-2,6-dioxocyclohexyl)methylideneamino]-5-methyl-3-thiophenecarboxylic acid ethyl ester ChEBI ID CHEBI:107364 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C17H21NO4S Net Charge 0 Average Mass 335.420 Monoisotopic Mass 335.11913 InChI InChI=1S/C17H21NO4S/c1-5-22-16(21)11-6-10(2)23-15(11)18-9-12-13(19)7-17(3,4)8-14(12)20/h6,9,12H,5,7-8H2,1-4H3 InChIKey GHQPDFDSYXHBEW-UHFFFAOYSA-N SMILES CCOC(=O)C1=C(SC(=C1)C)N=CC2C(=O)CC(CC2=O)(C)C Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 2-[(4,4-dimethyl-2,6-dioxocyclohexyl)methylideneamino]-5-methyl-3-thiophenecarboxylic acid ethyl ester (CHEBI:107364) is a thiophenecarboxylic acid (CHEBI:48436) Manual Xref Database LSM-18718 LINCS View more database links