methyl 3-[3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoylamino]-4-methyl-benzoate CAS Name: 3-[[3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-1-oxopropyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoylamino]-4-methylbenzoate Traditional Name: 3-[3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)propanoylamino]-4-methyl-benzoic acid methyl ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=C(NC(=O)C(=C2C)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=C(NC(=O)C(=C2C)C#N)C

InChI

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