(1R,2S)-2-(4-chlorophenyl)-1-(3,5-diphenylpyrazol-1-yl)carbonyl-4-methyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,2S)-2-(4-chlorophenyl)-1-(3,5-diphenylpyrazol-1-yl)carbonyl-4-methyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,2S)-2-(4-chlorophenyl)-1-(3,5-diphenylpyrazole-1-carbonyl)-4-methyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,2S)-2-(4-chlorophenyl)-1-[(3,5-diphenyl-1-pyrazolyl)-oxomethyl]-4-methyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,2S)-2-(4-chlorophenyl)-1-(3,5-diphenylpyrazole-1-carbonyl)-4-methylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,2S)-2-(4-chlorophenyl)-1-(3,5-diphenylpyrazole-1-carbonyl)-4-methyl-cyclohex-3-ene-1-carboxylate Formula: C30H24ClN2O3- MolecularWeight: 495.97616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(CC1)(C(=O)N2C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)[O-])C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=C[C@H]([C@](CC1)(C(=O)N2C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)[O-])C5=CC=C(C=C5)Cl

InChI

InChI=1S/C30H25ClN2O3/c1-20-16-17-30(29(35)36,25(18-20)21-12-14-24(31)15-13-21)28(34)33-27(23-10-6-3-7-11-23)19-26(32-33)22-8-4-2-5-9-22/h2-15,18-19,25H,16-17H2,1H3,(H,35,36)/p-1/t25-,30+/m0/s1