2-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-5-nitro-benzenesulfonamide

Systemtic Name: 2-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-5-nitro-benzenesulfonamide Openeye Name: 2-[4-(3-methoxybenzoyl)piperazin-1-yl]-5-nitro-benzenesulfonamide CAS Name: 2-[4-[(3-methoxyphenyl)-oxomethyl]-1-piperazinyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-[4-(3-methoxybenzoyl)piperazin-1-yl]-5-nitrobenzenesulfonamide Traditional Name: 2-(4-m-anisoylpiperazino)-5-nitro-benzenesulfonamide Formula: C18H20N4O6S MolecularWeight: 420.4396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O6S/c1-28-15-4-2-3-13(11-15)18(23)21-9-7-20(8-10-21)16-6-5-14(22(24)25)12-17(16)29(19,26)27/h2-6,11-12H,7-10H2,1H3,(H2,19,26,27)