N-[(1-cyclopentylpiperidin-4-yl)methyl]-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[(1-cyclopentylpiperidin-4-yl)methyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[(1-cyclopentyl-4-piperidyl)methyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[(1-cyclopentyl-4-piperidinyl)methyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[(1-cyclopentylpiperidin-4-yl)methyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[(1-cyclopentyl-4-piperidyl)methyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2CCN(CC2)C3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2CCN(CC2)C3CCCC3

InChI

InChI=1S/C18H27N3O4S/c1-14-6-7-17(21(22)23)12-18(14)26(24,25)19-13-15-8-10-20(11-9-15)16-4-2-3-5-16/h6-7,12,15-16,19H,2-5,8-11,13H2,1H3