5-(4-dibenzofuran-2-ylsulfonylpiperazin-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-nitro-aniline

Systemtic Name: 5-(4-dibenzofuran-2-ylsulfonylpiperazin-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-nitro-aniline Openeye Name: 5-(4-dibenzofuran-2-ylsulfonylpiperazin-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-nitro-aniline CAS Name: 5-[4-(2-dibenzofuranylsulfonyl)-1-piperazinyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-nitroaniline IUPAC Name: 5-(4-dibenzofuran-2-ylsulfonylpiperazin-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-nitroaniline Traditional Name: [5-(4-dibenzofuran-2-ylsulfonylpiperazino)-2-nitro-phenyl]-homoveratryl-amine Formula: C32H32N4O7S MolecularWeight: 616.68408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OC6=CC=CC=C65)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OC6=CC=CC=C65)[N+](=O)[O-])OC

InChI

InChI=1S/C32H32N4O7S/c1-41-31-11-7-22(19-32(31)42-2)13-14-33-27-20-23(8-10-28(27)36(37)38)34-15-17-35(18-16-34)44(39,40)24-9-12-30-26(21-24)25-5-3-4-6-29(25)43-30/h3-12,19-21,33H,13-18H2,1-2H3