[2-(4-tert-butylphenyl)-4-oxidanylidene-quinazolin-3-yl] 3-chloranylbenzoate

Systemtic Name: [2-(4-tert-butylphenyl)-4-oxidanylidene-quinazolin-3-yl] 3-chloranylbenzoate Openeye Name: [2-(4-tert-butylphenyl)-4-oxo-quinazolin-3-yl] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [2-(4-tert-butylphenyl)-4-oxo-3-quinazolinyl] ester IUPAC Name: [2-(4-tert-butylphenyl)-4-oxoquinazolin-3-yl] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [2-(4-tert-butylphenyl)-4-keto-quinazolin-3-yl] ester Formula: C25H21ClN2O3 MolecularWeight: 432.89884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2OC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2OC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H21ClN2O3/c1-25(2,3)18-13-11-16(12-14-18)22-27-21-10-5-4-9-20(21)23(29)28(22)31-24(30)17-7-6-8-19(26)15-17/h4-15H,1-3H3