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

Systemtic Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-3-nitro-benzenesulfonamide Openeye Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-3-nitro-benzenesulfonamide CAS Name: 4-[4-(3-methoxyphenyl)-1-piperazinyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-3-nitrobenzenesulfonamide Traditional Name: 4-[4-(3-methoxyphenyl)piperazino]-3-nitro-benzenesulfonamide Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O5S/c1-26-14-4-2-3-13(11-14)19-7-9-20(10-8-19)16-6-5-15(27(18,24)25)12-17(16)21(22)23/h2-6,11-12H,7-10H2,1H3,(H2,18,24,25)