4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[4-(4-methoxyphenyl)-1-piperazinyl]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[4-(4-methoxyphenyl)piperazino]-N-methyl-3-nitro-benzenesulfonamide Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O5S/c1-19-28(25,26)16-7-8-17(18(13-16)22(23)24)21-11-9-20(10-12-21)14-3-5-15(27-2)6-4-14/h3-8,13,19H,9-12H2,1-2H3