5-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-N-(2,2-dimethylpropyl)-2-nitro-aniline

Systemtic Name: 5-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-N-(2,2-dimethylpropyl)-2-nitro-aniline Openeye Name: 5-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-N-(2,2-dimethylpropyl)-2-nitro-aniline CAS Name: 5-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-N-(2,2-dimethylpropyl)-2-nitroaniline IUPAC Name: 5-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-N-(2,2-dimethylpropyl)-2-nitroaniline Traditional Name: [5-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-2-nitro-phenyl]-neopentyl-amine Formula: C23H32N4O6S MolecularWeight: 492.58838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC1=C(C=CC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)CNC1=C(C=CC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H32N4O6S/c1-23(2,3)16-24-19-14-17(6-8-20(19)27(28)29)25-10-12-26(13-11-25)34(30,31)18-7-9-21(32-4)22(15-18)33-5/h6-9,14-15,24H,10-13,16H2,1-5H3