3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propyl 4-phenylbenzoate

Systemtic Name: 3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propyl 4-phenylbenzoate Openeye Name: 3-(2-methyl-4-oxo-quinazolin-3-yl)propyl 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid 3-(2-methyl-4-oxo-3-quinazolinyl)propyl ester IUPAC Name: 3-(2-methyl-4-oxoquinazolin-3-yl)propyl 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid 3-(4-keto-2-methyl-quinazolin-3-yl)propyl ester Formula: C25H22N2O3 MolecularWeight: 398.45378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCCOC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCCOC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3/c1-18-26-23-11-6-5-10-22(23)24(28)27(18)16-7-17-30-25(29)21-14-12-20(13-15-21)19-8-3-2-4-9-19/h2-6,8-15H,7,16-17H2,1H3