methyl 3-(4-methylphenyl)-3-[3-(4-oxidanylidenecinnolin-1-yl)propanoylamino]propanoate

Systemtic Name: methyl 3-(4-methylphenyl)-3-[3-(4-oxidanylidenecinnolin-1-yl)propanoylamino]propanoate Openeye Name: methyl 3-[3-(4-oxocinnolin-1-yl)propanoylamino]-3-(p-tolyl)propanoate CAS Name: 3-(4-methylphenyl)-3-[[1-oxo-3-(4-oxo-1-cinnolinyl)propyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-methylphenyl)-3-[3-(4-oxocinnolin-1-yl)propanoylamino]propanoate Traditional Name: 3-[3-(4-ketocinnolin-1-yl)propanoylamino]-3-(p-tolyl)propionic acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)CCN2C3=CC=CC=C3C(=O)C=N2

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)CCN2C3=CC=CC=C3C(=O)C=N2

InChI

InChI=1S/C22H23N3O4/c1-15-7-9-16(10-8-15)18(13-22(28)29-2)24-21(27)11-12-25-19-6-4-3-5-17(19)20(26)14-23-25/h3-10,14,18H,11-13H2,1-2H3,(H,24,27)