methyl 4-[2-(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(3-cyano-4,6-dimethyl-2-oxo-1-pyridyl)acetyl]amino]benzoate CAS Name: 4-[[2-(3-cyano-4,6-dimethyl-2-oxo-1-pyridinyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(3-cyano-4,6-dimethyl-2-oxopyridin-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(3-cyano-2-keto-4,6-dimethyl-1-pyridyl)acetyl]amino]benzoic acid methyl ester Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1CC(=O)NC2=CC=C(C=C2)C(=O)OC)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1CC(=O)NC2=CC=C(C=C2)C(=O)OC)C#N)C

InChI

InChI=1S/C18H17N3O4/c1-11-8-12(2)21(17(23)15(11)9-19)10-16(22)20-14-6-4-13(5-7-14)18(24)25-3/h4-8H,10H2,1-3H3,(H,20,22)