4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[4-(2,5-dimethoxybenzyl)piperazino]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C23H32N4O6S MolecularWeight: 492.58838

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H32N4O6S/c1-5-26(6-2)34(30,31)20-8-9-21(22(16-20)27(28)29)25-13-11-24(12-14-25)17-18-15-19(32-3)7-10-23(18)33-4/h7-10,15-16H,5-6,11-14,17H2,1-4H3