methyl (2Z)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-oxidanylidene-butanoate

Systemtic Name: methyl (2Z)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-oxidanylidene-butanoate Openeye Name: methyl (2Z)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-oxo-butanoate CAS Name: (2Z)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-oxobutanoic acid methyl ester IUPAC Name: methyl (2Z)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-oxobutanoate Traditional Name: (2Z)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-keto-butyric acid methyl ester Formula: C25H22N2O3 MolecularWeight: 398.45378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C1NC2=CC=CC=C2C(N1)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC(=O)/C(=C/1\NC2=CC=CC=C2C(N1)(C3=CC=CC=C3)C4=CC=CC=C4)/C(=O)OC

InChI

InChI=1S/C25H22N2O3/c1-17(28)22(24(29)30-2)23-26-21-16-10-9-15-20(21)25(27-23,18-11-5-3-6-12-18)19-13-7-4-8-14-19/h3-16,26-27H,1-2H3/b23-22-