1-[4-[4-(2-methylpropyl)phenyl]carbonylpiperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one

Systemtic Name: 1-[4-[4-(2-methylpropyl)phenyl]carbonylpiperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Openeye Name: 1-[4-(4-isobutylbenzoyl)-1-piperidyl]-3-(1-phenylpyrazol-4-yl)propan-1-one CAS Name: 1-[4-[[4-(2-methylpropyl)phenyl]-oxomethyl]-1-piperidinyl]-3-(1-phenyl-4-pyrazolyl)-1-propanone IUPAC Name: 1-[4-[4-(2-methylpropyl)benzoyl]piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Traditional Name: 1-[4-(4-isobutylbenzoyl)piperidino]-3-(1-phenylpyrazol-4-yl)propan-1-one Formula: C28H33N3O2 MolecularWeight: 443.58052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H33N3O2/c1-21(2)18-22-8-11-24(12-9-22)28(33)25-14-16-30(17-15-25)27(32)13-10-23-19-29-31(20-23)26-6-4-3-5-7-26/h3-9,11-12,19-21,25H,10,13-18H2,1-2H3