[4-(4-oxidanylidene-7,8-dihydro-1H-quinazolin-2-yl)phenyl] benzoate

Systemtic Name: [4-(4-oxidanylidene-7,8-dihydro-1H-quinazolin-2-yl)phenyl] benzoate Openeye Name: [4-(4-oxo-7,8-dihydro-1H-quinazolin-2-yl)phenyl] benzoate CAS Name: benzoic acid [4-(4-oxo-7,8-dihydro-1H-quinazolin-2-yl)phenyl] ester IUPAC Name: [4-(4-oxo-7,8-dihydro-1H-quinazolin-2-yl)phenyl] benzoate Traditional Name: benzoic acid [4-(4-keto-7,8-dihydro-1H-quinazolin-2-yl)phenyl] ester Formula: C21H16N2O3 MolecularWeight: 344.36334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C1)C(=O)N=C(N2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C=C1)C(=O)N=C(N2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O3/c24-20-17-8-4-5-9-18(17)22-19(23-20)14-10-12-16(13-11-14)26-21(25)15-6-2-1-3-7-15/h1-4,6-8,10-13H,5,9H2,(H,22,23,24)