ethyl 4-[[(E)-2-[(6-methylpyridin-2-yl)carbamoyl]-3-oxidanylidene-but-1-enyl]amino]benzoate

Systemtic Name: ethyl 4-[[(E)-2-[(6-methylpyridin-2-yl)carbamoyl]-3-oxidanylidene-but-1-enyl]amino]benzoate Openeye Name: ethyl 4-[[(E)-2-[(6-methyl-2-pyridyl)carbamoyl]-3-oxo-but-1-enyl]amino]benzoate CAS Name: 4-[[(E)-2-[[(6-methyl-2-pyridinyl)amino]-oxomethyl]-3-oxobut-1-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-2-[(6-methylpyridin-2-yl)carbamoyl]-3-oxobut-1-enyl]amino]benzoate Traditional Name: 4-[[(E)-3-keto-2-[(6-methyl-2-pyridyl)carbamoyl]but-1-enyl]amino]benzoic acid ethyl ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC=C(C(=O)C)C(=O)NC2=CC=CC(=N2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N/C=C(\C(=O)C)/C(=O)NC2=CC=CC(=N2)C

InChI

InChI=1S/C20H21N3O4/c1-4-27-20(26)15-8-10-16(11-9-15)21-12-17(14(3)24)19(25)23-18-7-5-6-13(2)22-18/h5-12,21H,4H2,1-3H3,(H,22,23,25)/b17-12+