2-nitro-N-pyrrolidin-3-yl-N-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-pyrrolidin-3-yl-N-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]benzenesulfonamide Openeye Name: 2-nitro-N-pyrrolidin-3-yl-N-[[2-(3,4,5-trimethoxyphenyl)-4-pyridyl]methyl]benzenesulfonamide CAS Name: 2-nitro-N-(3-pyrrolidinyl)-N-[[2-(3,4,5-trimethoxyphenyl)-4-pyridinyl]methyl]benzenesulfonamide IUPAC Name: 2-nitro-N-pyrrolidin-3-yl-N-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]benzenesulfonamide Traditional Name: 2-nitro-N-pyrrolidin-3-yl-N-[[2-(3,4,5-trimethoxyphenyl)-4-pyridyl]methyl]benzenesulfonamide Formula: C25H28N4O7S MolecularWeight: 528.57742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC=CC(=C2)CN(C3CCNC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC=CC(=C2)CN(C3CCNC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C25H28N4O7S/c1-34-22-13-18(14-23(35-2)25(22)36-3)20-12-17(8-11-27-20)16-28(19-9-10-26-15-19)37(32,33)24-7-5-4-6-21(24)29(30)31/h4-8,11-14,19,26H,9-10,15-16H2,1-3H3