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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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