3-nitro-N-(2-piperazin-1-ylethyl)benzenesulfonamide

Systemtic Name: 3-nitro-N-(2-piperazin-1-ylethyl)benzenesulfonamide Openeye Name: 3-nitro-N-(2-piperazin-1-ylethyl)benzenesulfonamide CAS Name: 3-nitro-N-[2-(1-piperazinyl)ethyl]benzenesulfonamide IUPAC Name: 3-nitro-N-(2-piperazin-1-ylethyl)benzenesulfonamide Traditional Name: 3-nitro-N-(2-piperazinoethyl)benzenesulfonamide Formula: C12H18N4O4S MolecularWeight: 314.36072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCNS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)CCNS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H18N4O4S/c17-16(18)11-2-1-3-12(10-11)21(19,20)14-6-9-15-7-4-13-5-8-15/h1-3,10,13-14H,4-9H2