4-[bis(2-chlorophenyl)methylamino]-N-methyl-N-(1-methylpiperidin-4-yl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-[bis(2-chlorophenyl)methylamino]-N-methyl-N-(1-methylpiperidin-4-yl)-3-nitro-benzenesulfonamide Openeye Name: 4-[bis(2-chlorophenyl)methylamino]-N-methyl-N-(1-methyl-4-piperidyl)-3-nitro-benzenesulfonamide CAS Name: 4-[bis(2-chlorophenyl)methylamino]-N-methyl-N-(1-methyl-4-piperidinyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-[bis(2-chlorophenyl)methylamino]-N-methyl-N-(1-methylpiperidin-4-yl)-3-nitrobenzenesulfonamide Traditional Name: 4-[bis(2-chlorophenyl)methylamino]-N-methyl-N-(1-methyl-4-piperidyl)-3-nitro-benzenesulfonamide Formula: C26H28Cl2N4O4S MolecularWeight: 563.49592

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)S(=O)(=O)C2=CC(=C(C=C2)NC(C3=CC=CC=C3Cl)C4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

CN1CCC(CC1)N(C)S(=O)(=O)C2=CC(=C(C=C2)NC(C3=CC=CC=C3Cl)C4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C26H28Cl2N4O4S/c1-30-15-13-18(14-16-30)31(2)37(35,36)19-11-12-24(25(17-19)32(33)34)29-26(20-7-3-5-9-22(20)27)21-8-4-6-10-23(21)28/h3-12,17-18,26,29H,13-16H2,1-2H3