2-[2-[[3-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 2-[2-[[3-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 2-[2-[3-(6-methyl-4-oxo-1H-pyrimidin-2-yl)anilino]-2-oxo-ethyl]benzoic acid CAS Name: 2-[2-[3-(6-methyl-4-oxo-1H-pyrimidin-2-yl)anilino]-2-oxoethyl]benzoic acid IUPAC Name: 2-[2-[3-(6-methyl-4-oxo-1H-pyrimidin-2-yl)anilino]-2-oxoethyl]benzoic acid Traditional Name: 2-[2-keto-2-[3-(4-keto-6-methyl-1H-pyrimidin-2-yl)anilino]ethyl]benzoic acid Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)C2=CC(=CC=C2)NC(=O)CC3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)C2=CC(=CC=C2)NC(=O)CC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H17N3O4/c1-12-9-17(24)23-19(21-12)14-6-4-7-15(10-14)22-18(25)11-13-5-2-3-8-16(13)20(26)27/h2-10H,11H2,1H3,(H,22,25)(H,26,27)(H,21,23,24)