N-(5-chloranyl-2-methoxy-phenyl)-4-methyl-N-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-methyl-N-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-methyl-N-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-3-nitro-benzenesulfonamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-methyl-N-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-methyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-nitrobenzenesulfonamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-N-[2-keto-2-(4-methylpiperidino)ethyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C22H26ClN3O6S MolecularWeight: 495.97634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3O6S/c1-15-8-10-24(11-9-15)22(27)14-25(20-12-17(23)5-7-21(20)32-3)33(30,31)18-6-4-16(2)19(13-18)26(28)29/h4-7,12-13,15H,8-11,14H2,1-3H3