(4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-bromanyl-4-methoxy-benzoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-bromanyl-4-methoxy-benzoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C17H13BrN2O4 MolecularWeight: 389.20012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC2=NC(=O)C3=CC=CC=C3N2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC2=NC(=O)C3=CC=CC=C3N2)Br

InChI

InChI=1S/C17H13BrN2O4/c1-23-14-7-6-10(8-12(14)18)17(22)24-9-15-19-13-5-3-2-4-11(13)16(21)20-15/h2-8H,9H2,1H3,(H,19,20,21)