1-(3,5-diphenylpyrazol-1-yl)carbonyl-4-methyl-6-phenyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 1-(3,5-diphenylpyrazol-1-yl)carbonyl-4-methyl-6-phenyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 1-(3,5-diphenylpyrazole-1-carbonyl)-4-methyl-6-phenyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 1-[(3,5-diphenyl-1-pyrazolyl)-oxomethyl]-4-methyl-6-phenyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 1-(3,5-diphenylpyrazole-1-carbonyl)-4-methyl-6-phenylcyclohex-3-ene-1-carboxylic acid Traditional Name: 1-(3,5-diphenylpyrazole-1-carbonyl)-4-methyl-6-phenyl-cyclohex-3-ene-1-carboxylic acid Formula: C30H26N2O3 MolecularWeight: 462.53904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(C1)C2=CC=CC=C2)(C(=O)N3C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CC1=CCC(C(C1)C2=CC=CC=C2)(C(=O)N3C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C30H26N2O3/c1-21-17-18-30(29(34)35,25(19-21)22-11-5-2-6-12-22)28(33)32-27(24-15-9-4-10-16-24)20-26(31-32)23-13-7-3-8-14-23/h2-17,20,25H,18-19H2,1H3,(H,34,35)