N-[2-(4-methylpiperazin-1-yl)ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-3-nitro-benzenesulfonamide CAS Name: N-[2-(4-methyl-1-piperazinyl)ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-(4-methylpiperazino)ethyl]-3-nitro-benzenesulfonamide Formula: C13H20N4O4S MolecularWeight: 328.3873

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)CCNS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H20N4O4S/c1-15-7-9-16(10-8-15)6-5-14-22(20,21)13-4-2-3-12(11-13)17(18)19/h2-4,11,14H,5-10H2,1H3