3,3-dimethyl-2-pyrrol-1-yl-1-[3-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-yl]butan-1-one

Systemtic Name: 3,3-dimethyl-2-pyrrol-1-yl-1-[3-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-yl]butan-1-one Openeye Name: 3,3-dimethyl-2-pyrrol-1-yl-1-[3-[[4-(trifluoromethyl)phenyl]methyl]-1-piperidyl]butan-1-one CAS Name: 3,3-dimethyl-2-(1-pyrrolyl)-1-[3-[[4-(trifluoromethyl)phenyl]methyl]-1-piperidinyl]-1-butanone IUPAC Name: 3,3-dimethyl-2-pyrrol-1-yl-1-[3-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-yl]butan-1-one Traditional Name: 3,3-dimethyl-2-pyrrol-1-yl-1-[3-[4-(trifluoromethyl)benzyl]piperidino]butan-1-one Formula: C23H29F3N2O MolecularWeight: 406.48437

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CCCC(C1)CC2=CC=C(C=C2)C(F)(F)F)N3C=CC=C3

Isomeric SMILES

CC(C)(C)C(C(=O)N1CCCC(C1)CC2=CC=C(C=C2)C(F)(F)F)N3C=CC=C3

InChI

InChI=1S/C23H29F3N2O/c1-22(2,3)20(27-12-4-5-13-27)21(29)28-14-6-7-18(16-28)15-17-8-10-19(11-9-17)23(24,25)26/h4-5,8-13,18,20H,6-7,14-16H2,1-3H3