N-[4-nitro-3-(trifluoromethyl)phenyl]-4-(1-octylsulfonylpiperidin-4-yl)butanamide

Systemtic Name: N-[4-nitro-3-(trifluoromethyl)phenyl]-4-(1-octylsulfonylpiperidin-4-yl)butanamide Openeye Name: N-[4-nitro-3-(trifluoromethyl)phenyl]-4-(1-octylsulfonyl-4-piperidyl)butanamide CAS Name: N-[4-nitro-3-(trifluoromethyl)phenyl]-4-(1-octylsulfonyl-4-piperidinyl)butanamide IUPAC Name: N-[4-nitro-3-(trifluoromethyl)phenyl]-4-(1-octylsulfonylpiperidin-4-yl)butanamide Traditional Name: N-[4-nitro-3-(trifluoromethyl)phenyl]-4-(1-octylsulfonyl-4-piperidyl)butyramide Formula: C24H36F3N3O5S MolecularWeight: 535.61995

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N1CCC(CC1)CCCC(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCCCCCCCS(=O)(=O)N1CCC(CC1)CCCC(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C24H36F3N3O5S/c1-2-3-4-5-6-7-17-36(34,35)29-15-13-19(14-16-29)9-8-10-23(31)28-20-11-12-22(30(32)33)21(18-20)24(25,26)27/h11-12,18-19H,2-10,13-17H2,1H3,(H,28,31)