N-[(1-cyclopentylpiperidin-4-yl)methyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[(1-cyclopentylpiperidin-4-yl)methyl]-3-nitro-benzenesulfonamide Openeye Name: N-[(1-cyclopentyl-4-piperidyl)methyl]-3-nitro-benzenesulfonamide CAS Name: N-[(1-cyclopentyl-4-piperidinyl)methyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[(1-cyclopentylpiperidin-4-yl)methyl]-3-nitrobenzenesulfonamide Traditional Name: N-[(1-cyclopentyl-4-piperidyl)methyl]-3-nitro-benzenesulfonamide Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC(CC2)CNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)N2CCC(CC2)CNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O4S/c21-20(22)16-6-3-7-17(12-16)25(23,24)18-13-14-8-10-19(11-9-14)15-4-1-2-5-15/h3,6-7,12,14-15,18H,1-2,4-5,8-11,13H2