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

Systemtic Name: 2-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-[(1-methyl-4-piperidyl)methyl]-5-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[(1-methyl-4-piperidinyl)methyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-nitrobenzenesulfonamide Traditional Name: 2-methyl-N-[(1-methyl-4-piperidyl)methyl]-5-nitro-benzenesulfonamide Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O4S/c1-11-3-4-13(17(18)19)9-14(11)22(20,21)15-10-12-5-7-16(2)8-6-12/h3-4,9,12,15H,5-8,10H2,1-2H3