N,N-diethyl-5-nitro-2-(4-phenylpiperazin-1-yl)benzenesulfonamide

Systemtic Name: N,N-diethyl-5-nitro-2-(4-phenylpiperazin-1-yl)benzenesulfonamide Openeye Name: N,N-diethyl-5-nitro-2-(4-phenylpiperazin-1-yl)benzenesulfonamide CAS Name: N,N-diethyl-5-nitro-2-(4-phenyl-1-piperazinyl)benzenesulfonamide IUPAC Name: N,N-diethyl-5-nitro-2-(4-phenylpiperazin-1-yl)benzenesulfonamide Traditional Name: N,N-diethyl-5-nitro-2-(4-phenylpiperazino)benzenesulfonamide Formula: C20H26N4O4S MolecularWeight: 418.50984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O4S/c1-3-23(4-2)29(27,28)20-16-18(24(25)26)10-11-19(20)22-14-12-21(13-15-22)17-8-6-5-7-9-17/h5-11,16H,3-4,12-15H2,1-2H3