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

Systemtic Name: 4-[[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)amino]methyl]benzoic acid Openeye Name: 4-[[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]methyl]benzoic acid CAS Name: 4-[[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]methyl]benzoic acid IUPAC Name: 4-[[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]methyl]benzoic acid Traditional Name: 4-[[(4-keto-6-methyl-1H-pyrimidin-2-yl)amino]methyl]benzoic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H13N3O3/c1-8-6-11(17)16-13(15-8)14-7-9-2-4-10(5-3-9)12(18)19/h2-6H,7H2,1H3,(H,18,19)(H2,14,15,16,17)