(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 4-azanylbenzoate

Systemtic Name: (7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 4-azanylbenzoate Openeye Name: (7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 4-aminobenzoate CAS Name: 4-aminobenzoic acid (7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 4-aminobenzoate Traditional Name: 4-aminobenzoic acid (7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C16H12BrN3O3 MolecularWeight: 374.18878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC2=CC(=O)N3C=C(C=CC3=N2)Br)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC2=CC(=O)N3C=C(C=CC3=N2)Br)N

InChI

InChI=1S/C16H12BrN3O3/c17-11-3-6-14-19-13(7-15(21)20(14)8-11)9-23-16(22)10-1-4-12(18)5-2-10/h1-8H,9,18H2