3,5-dimethyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]piperidine-1-sulfonamide

Systemtic Name: 3,5-dimethyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]piperidine-1-sulfonamide Openeye Name: 3,5-dimethyl-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]piperidine-1-sulfonamide CAS Name: 3,5-dimethyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-1-piperidinesulfonamide IUPAC Name: 3,5-dimethyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]piperidine-1-sulfonamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]-3,5-dimethyl-piperidine-1-sulfonamide Formula: C16H26N4O6S2 MolecularWeight: 434.53084

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C

InChI

InChI=1S/C16H26N4O6S2/c1-12-8-13(2)11-19(10-12)28(25,26)18-7-6-17-15-5-4-14(27(3,23)24)9-16(15)20(21)22/h4-5,9,12-13,17-18H,6-8,10-11H2,1-3H3