2-(3-methyl-5-oxidanylidene-1,2-diphenyl-pyrazol-4-yl)ethanoic acid

Systemtic Name: 2-(3-methyl-5-oxidanylidene-1,2-diphenyl-pyrazol-4-yl)ethanoic acid Openeye Name: 2-(3-methyl-5-oxo-1,2-diphenyl-pyrazol-4-yl)acetic acid CAS Name: 2-(3-methyl-5-oxo-1,2-diphenyl-4-pyrazolyl)acetic acid IUPAC Name: 2-(3-methyl-5-oxo-1,2-diphenylpyrazol-4-yl)acetic acid Traditional Name: 2-(3-keto-5-methyl-1,2-diphenyl-3-pyrazolin-4-yl)acetic acid Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)O

Isomeric SMILES

CC1=C(C(=O)N(N1C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C18H16N2O3/c1-13-16(12-17(21)22)18(23)20(15-10-6-3-7-11-15)19(13)14-8-4-2-5-9-14/h2-11H,12H2,1H3,(H,21,22)