methyl 2-[3-[2-(4-bromophenyl)-4-oxidanylidene-quinazolin-3-yl]propoxy]benzoate

Systemtic Name: methyl 2-[3-[2-(4-bromophenyl)-4-oxidanylidene-quinazolin-3-yl]propoxy]benzoate Openeye Name: methyl 2-[3-[2-(4-bromophenyl)-4-oxo-quinazolin-3-yl]propoxy]benzoate CAS Name: 2-[3-[2-(4-bromophenyl)-4-oxo-3-quinazolinyl]propoxy]benzoic acid methyl ester IUPAC Name: methyl 2-[3-[2-(4-bromophenyl)-4-oxoquinazolin-3-yl]propoxy]benzoate Traditional Name: 2-[3-[2-(4-bromophenyl)-4-keto-quinazolin-3-yl]propoxy]benzoic acid methyl ester Formula: C25H21BrN2O4 MolecularWeight: 493.34924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1OCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC(=O)C1=CC=CC=C1OCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H21BrN2O4/c1-31-25(30)20-8-3-5-10-22(20)32-16-6-15-28-23(17-11-13-18(26)14-12-17)27-21-9-4-2-7-19(21)24(28)29/h2-5,7-14H,6,15-16H2,1H3