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

Systemtic Name: 2-methyl-5-nitro-N-[(1-phenethylpiperidin-4-yl)methyl]benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-[(1-phenethyl-4-piperidyl)methyl]benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-[(1-phenethyl-4-piperidinyl)methyl]benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-[(1-phenethylpiperidin-4-yl)methyl]benzenesulfonamide Traditional Name: 2-methyl-5-nitro-N-[(1-phenethyl-4-piperidyl)methyl]benzenesulfonamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2CCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O4S/c1-17-7-8-20(24(25)26)15-21(17)29(27,28)22-16-19-10-13-23(14-11-19)12-9-18-5-3-2-4-6-18/h2-8,15,19,22H,9-14,16H2,1H3