N-(4-methoxyphenyl)-4-methyl-3-nitro-N-(2-oxidanylidene-2-piperidin-1-yl-ethyl)benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-4-methyl-3-nitro-N-(2-oxidanylidene-2-piperidin-1-yl-ethyl)benzenesulfonamide Openeye Name: N-(4-methoxyphenyl)-4-methyl-3-nitro-N-[2-oxo-2-(1-piperidyl)ethyl]benzenesulfonamide CAS Name: N-(4-methoxyphenyl)-4-methyl-3-nitro-N-[2-oxo-2-(1-piperidinyl)ethyl]benzenesulfonamide IUPAC Name: N-(4-methoxyphenyl)-4-methyl-3-nitro-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide Traditional Name: N-(2-keto-2-piperidino-ethyl)-N-(4-methoxyphenyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCCCC2)C3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCCCC2)C3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O6S/c1-16-6-11-19(14-20(16)24(26)27)31(28,29)23(17-7-9-18(30-2)10-8-17)15-21(25)22-12-4-3-5-13-22/h6-11,14H,3-5,12-13,15H2,1-2H3