[2-(4-bromophenyl)-4-oxidanylidene-quinazolin-3-yl] 4-butylbenzoate

Systemtic Name: [2-(4-bromophenyl)-4-oxidanylidene-quinazolin-3-yl] 4-butylbenzoate Openeye Name: [2-(4-bromophenyl)-4-oxo-quinazolin-3-yl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [2-(4-bromophenyl)-4-oxo-3-quinazolinyl] ester IUPAC Name: [2-(4-bromophenyl)-4-oxoquinazolin-3-yl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [2-(4-bromophenyl)-4-keto-quinazolin-3-yl] ester Formula: C25H21BrN2O3 MolecularWeight: 477.34984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)ON2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)ON2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H21BrN2O3/c1-2-3-6-17-9-11-19(12-10-17)25(30)31-28-23(18-13-15-20(26)16-14-18)27-22-8-5-4-7-21(22)24(28)29/h4-5,7-16H,2-3,6H2,1H3