1-(4-bromophenyl)sulfonyl-4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-4-nitro-phenyl]piperazine

Systemtic Name: 1-(4-bromophenyl)sulfonyl-4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-4-nitro-phenyl]piperazine Openeye Name: 1-(4-bromophenyl)sulfonyl-4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-4-nitro-phenyl]piperazine CAS Name: 1-(4-bromophenyl)sulfonyl-4-[3-[4-(2-methoxyphenyl)-1-piperazinyl]-4-nitrophenyl]piperazine IUPAC Name: 1-(4-bromophenyl)sulfonyl-4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-4-nitrophenyl]piperazine Traditional Name: 1-brosyl-4-[3-[4-(2-methoxyphenyl)piperazino]-4-nitro-phenyl]piperazine Formula: C27H30BrN5O5S MolecularWeight: 616.5266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=CC(=C3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=CC(=C3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Br)[N+](=O)[O-]

InChI

InChI=1S/C27H30BrN5O5S/c1-38-27-5-3-2-4-25(27)30-12-14-31(15-13-30)26-20-22(8-11-24(26)33(34)35)29-16-18-32(19-17-29)39(36,37)23-9-6-21(28)7-10-23/h2-11,20H,12-19H2,1H3