1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-N-prop-2-enyl-piperidine-4-carboxamide

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-N-prop-2-enyl-piperidine-4-carboxamide Openeye Name: N-allyl-1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-prop-2-enyl-4-piperidinecarboxamide IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-prop-2-enylpiperidine-4-carboxamide Traditional Name: N-allyl-1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C16H18ClF3N2O3S MolecularWeight: 410.83893

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

C=CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C16H18ClF3N2O3S/c1-2-7-21-15(23)11-5-8-22(9-6-11)26(24,25)12-3-4-14(17)13(10-12)16(18,19)20/h2-4,10-11H,1,5-9H2,(H,21,23)