1-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one

Systemtic Name: 1-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Openeye Name: 3-(1-phenylpyrazol-4-yl)-1-[4-[2-(p-tolyl)ethyl]-1-piperidyl]propan-1-one CAS Name: 1-[4-[2-(4-methylphenyl)ethyl]-1-piperidinyl]-3-(1-phenyl-4-pyrazolyl)-1-propanone IUPAC Name: 1-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Traditional Name: 3-(1-phenylpyrazol-4-yl)-1-[4-[2-(p-tolyl)ethyl]piperidino]propan-1-one Formula: C26H31N3O MolecularWeight: 401.54384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H31N3O/c1-21-7-9-22(10-8-21)11-12-23-15-17-28(18-16-23)26(30)14-13-24-19-27-29(20-24)25-5-3-2-4-6-25/h2-10,19-20,23H,11-18H2,1H3