3-[7-(2-hydroxyphenyl)carbonyl-2-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]propanoic acid

Systemtic Name: 3-[7-(2-hydroxyphenyl)carbonyl-2-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]propanoic acid Openeye Name: 3-[7-(2-hydroxybenzoyl)-2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]propanoic acid CAS Name: 3-[7-[(2-hydroxyphenyl)-oxomethyl]-2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]propanoic acid IUPAC Name: 3-[7-(2-hydroxybenzoyl)-2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]propanoic acid Traditional Name: 3-(4-keto-2-methyl-7-salicyloyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)propionic acid Formula: C19H17N2O5+ MolecularWeight: 353.34868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)[N+]2=C(N1)C=CC(=C2)C(=O)C3=CC=CC=C3O)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)[N+]2=C(N1)C=CC(=C2)C(=O)C3=CC=CC=C3O)CCC(=O)O

InChI

InChI=1S/C19H16N2O5/c1-11-13(7-9-17(23)24)19(26)21-10-12(6-8-16(21)20-11)18(25)14-4-2-3-5-15(14)22/h2-6,8,10H,7,9H2,1H3,(H2,22,23,24,25)/p+1