(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 3-phenylmethoxybenzoate

Systemtic Name: (4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 3-phenylmethoxybenzoate Openeye Name: (4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 3-benzyloxybenzoate CAS Name: 3-phenylmethoxybenzoic acid (4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester IUPAC Name: (4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 3-phenylmethoxybenzoate Traditional Name: 3-benzoxybenzoic acid (4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester Formula: C23H19N2O4+ MolecularWeight: 387.40796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)OCC3=CC(=O)[N+]4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)OCC3=CC(=O)[N+]4=CC=CC=C4N3

InChI

InChI=1S/C23H18N2O4/c26-22-14-19(24-21-11-4-5-12-25(21)22)16-29-23(27)18-9-6-10-20(13-18)28-15-17-7-2-1-3-8-17/h1-14H,15-16H2/p+1