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

Systemtic Name: propan-2-yl 4-[3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanoylamino]benzoate Openeye Name: isopropyl 4-[3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoylamino]benzoate CAS Name: 4-[[3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-1-oxopropyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoylamino]benzoate Traditional Name: 4-[3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)propanoylamino]benzoic acid isopropyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C)C)C#N

InChI

InChI=1S/C21H23N3O4/c1-12(2)28-21(27)15-5-7-16(8-6-15)24-19(25)10-9-17-13(3)18(11-22)20(26)23-14(17)4/h5-8,12H,9-10H2,1-4H3,(H,23,26)(H,24,25)