4-nitro-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]benzenesulfonamide

Systemtic Name: 4-nitro-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-4-nitro-benzenesulfonamide CAS Name: 4-nitro-N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]benzenesulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]-4-nitro-benzenesulfonamide Formula: C19H24N4O4S MolecularWeight: 404.48326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H24N4O4S/c24-23(25)18-6-8-19(9-7-18)28(26,27)20-10-11-21-12-14-22(15-13-21)16-17-4-2-1-3-5-17/h1-9,20H,10-16H2