[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: [2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]methanone CAS Name: [2-(2,4-dimethylphenyl)-5-phenyl-3-pyrazolyl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-[2-(2,4-dimethylphenyl)-5-phenylpyrazol-3-yl]methanone Traditional Name: (4-benzylpiperidino)-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]methanone Formula: C30H31N3O MolecularWeight: 449.58664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)C(=O)N4CCC(CC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)C(=O)N4CCC(CC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C30H31N3O/c1-22-13-14-28(23(2)19-22)33-29(21-27(31-33)26-11-7-4-8-12-26)30(34)32-17-15-25(16-18-32)20-24-9-5-3-6-10-24/h3-14,19,21,25H,15-18,20H2,1-2H3