[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 3-(3-methyl-4-oxo-quinazolin-2-yl)propanoate CAS Name: 3-(3-methyl-4-oxo-2-quinazolinyl)propanoic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] 3-(3-methyl-4-oxoquinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-3-methyl-quinazolin-2-yl)propionic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)CCC2=NC3=CC=CC=C3C(=O)N2C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)CCC2=NC3=CC=CC=C3C(=O)N2C)C

InChI

InChI=1S/C22H23N3O4/c1-14-8-9-16(12-15(14)2)23-20(26)13-29-21(27)11-10-19-24-18-7-5-4-6-17(18)22(28)25(19)3/h4-9,12H,10-11,13H2,1-3H3,(H,23,26)