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

Systemtic Name: 4-chloranyl-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[2-(4-methyl-1-piperazinyl)phenyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[2-(4-methylpiperazino)phenyl]-3-nitro-benzenesulfonamide Formula: C17H19ClN4O4S MolecularWeight: 410.87516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H19ClN4O4S/c1-20-8-10-21(11-9-20)16-5-3-2-4-15(16)19-27(25,26)13-6-7-14(18)17(12-13)22(23)24/h2-7,12,19H,8-11H2,1H3