1-(3,5-diphenylpyrazol-1-yl)carbonyl-4-methyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 1-(3,5-diphenylpyrazol-1-yl)carbonyl-4-methyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 1-(3,5-diphenylpyrazole-1-carbonyl)-4-methyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 1-[(3,5-diphenyl-1-pyrazolyl)-oxomethyl]-4-methyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 1-(3,5-diphenylpyrazole-1-carbonyl)-4-methylcyclohex-3-ene-1-carboxylic acid Traditional Name: 1-(3,5-diphenylpyrazole-1-carbonyl)-4-methyl-cyclohex-3-ene-1-carboxylic acid Formula: C24H22N2O3 MolecularWeight: 386.44308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1)(C(=O)N2C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=CCC(CC1)(C(=O)N2C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H22N2O3/c1-17-12-14-24(15-13-17,23(28)29)22(27)26-21(19-10-6-3-7-11-19)16-20(25-26)18-8-4-2-5-9-18/h2-12,16H,13-15H2,1H3,(H,28,29)