N-(2-methoxyphenyl)-5-nitro-2-[[1-(phenylmethyl)piperidin-4-yl]amino]benzenesulfonamide

Systemtic Name: N-(2-methoxyphenyl)-5-nitro-2-[[1-(phenylmethyl)piperidin-4-yl]amino]benzenesulfonamide Openeye Name: 2-[(1-benzyl-4-piperidyl)amino]-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide CAS Name: N-(2-methoxyphenyl)-5-nitro-2-[[1-(phenylmethyl)-4-piperidinyl]amino]benzenesulfonamide IUPAC Name: 2-[(1-benzylpiperidin-4-yl)amino]-N-(2-methoxyphenyl)-5-nitrobenzenesulfonamide Traditional Name: 2-[(1-benzyl-4-piperidyl)amino]-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide Formula: C25H28N4O5S MolecularWeight: 496.57862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O5S/c1-34-24-10-6-5-9-22(24)27-35(32,33)25-17-21(29(30)31)11-12-23(25)26-20-13-15-28(16-14-20)18-19-7-3-2-4-8-19/h2-12,17,20,26-27H,13-16,18H2,1H3