N-(4-methoxyphenyl)-4-methyl-N-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-4-methyl-N-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-(4-methoxyphenyl)-4-methyl-N-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-3-nitro-benzenesulfonamide CAS Name: N-(4-methoxyphenyl)-4-methyl-N-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-(4-methoxyphenyl)-4-methyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-keto-2-(4-methylpiperidino)ethyl]-N-(4-methoxyphenyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O6S/c1-16-10-12-23(13-11-16)22(26)15-24(18-5-7-19(31-3)8-6-18)32(29,30)20-9-4-17(2)21(14-20)25(27)28/h4-9,14,16H,10-13,15H2,1-3H3