3-[[5-[(4-methoxyphenyl)methyl]-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl]amino]benzoic acid

Systemtic Name: 3-[[5-[(4-methoxyphenyl)methyl]-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl]amino]benzoic acid Openeye Name: 3-[[4-hydroxy-5-[(4-methoxyphenyl)methyl]-6-oxo-1H-pyrimidin-2-yl]amino]benzoic acid CAS Name: 3-[[4-hydroxy-5-[(4-methoxyphenyl)methyl]-6-oxo-1H-pyrimidin-2-yl]amino]benzoic acid IUPAC Name: 3-[[4-hydroxy-5-[(4-methoxyphenyl)methyl]-6-oxo-1H-pyrimidin-2-yl]amino]benzoic acid Traditional Name: 3-[(4-hydroxy-6-keto-5-p-anisyl-1H-pyrimidin-2-yl)amino]benzoic acid Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NC3=CC=CC(=C3)C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NC3=CC=CC(=C3)C(=O)O)O

InChI

InChI=1S/C19H17N3O5/c1-27-14-7-5-11(6-8-14)9-15-16(23)21-19(22-17(15)24)20-13-4-2-3-12(10-13)18(25)26/h2-8,10H,9H2,1H3,(H,25,26)(H3,20,21,22,23,24)