1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]piperidine-3-carboxamide

Systemtic Name: 1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]piperidine-3-carboxamide Openeye Name: 1-butyl-2-(2-methoxyphenyl)-6-oxo-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]piperidine-3-carboxamide CAS Name: 1-butyl-2-(2-methoxyphenyl)-6-oxo-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-3-piperidinecarboxamide IUPAC Name: 1-butyl-2-(2-methoxyphenyl)-6-oxo-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]piperidine-3-carboxamide Traditional Name: 1-butyl-6-keto-2-(2-methoxyphenyl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]nipecotamide Formula: C27H29F3N2O3 MolecularWeight: 486.52597

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)NCC#CC2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=C3OC

Isomeric SMILES

CCCCN1C(C(CCC1=O)C(=O)NCC#CC2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=C3OC

InChI

InChI=1S/C27H29F3N2O3/c1-3-4-17-32-24(33)15-14-22(25(32)21-12-5-6-13-23(21)35-2)26(34)31-16-8-10-19-9-7-11-20(18-19)27(28,29)30/h5-7,9,11-13,18,22,25H,3-4,14-17H2,1-2H3,(H,31,34)