4-chloranyl-N-(2,4-dimethylphenyl)-N-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2,4-dimethylphenyl)-N-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(2,4-dimethylphenyl)-N-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-(2,4-dimethylphenyl)-N-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(2,4-dimethylphenyl)-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(2,4-dimethylphenyl)-N-[2-keto-2-(4-methylpiperidino)ethyl]-3-nitro-benzenesulfonamide Formula: C22H26ClN3O5S MolecularWeight: 479.97694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3O5S/c1-15-8-10-24(11-9-15)22(27)14-25(20-7-4-16(2)12-17(20)3)32(30,31)18-5-6-19(23)21(13-18)26(28)29/h4-7,12-13,15H,8-11,14H2,1-3H3