4-[4-[(3-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)oxymethyl]phenyl]carbonylbenzoic acid

Systemtic Name: 4-[4-[(3-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)oxymethyl]phenyl]carbonylbenzoic acid Openeye Name: 4-[4-[(3-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)oxymethyl]benzoyl]benzoic acid CAS Name: 4-[[4-[(3-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)oxymethyl]phenyl]-oxomethyl]benzoic acid IUPAC Name: 4-[4-[(3-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)oxymethyl]benzoyl]benzoic acid Traditional Name: 4-[4-[(4-keto-3-methyl-pyrido[1,2-a]pyrimidin-2-yl)oxymethyl]benzoyl]benzoic acid Formula: C24H18N2O5 MolecularWeight: 414.41012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC=CN2C1=O)OCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC1=C(N=C2C=CC=CN2C1=O)OCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H18N2O5/c1-15-22(25-20-4-2-3-13-26(20)23(15)28)31-14-16-5-7-17(8-6-16)21(27)18-9-11-19(12-10-18)24(29)30/h2-13H,14H2,1H3,(H,29,30)