3-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-N-cyclopropyl-benzenesulfonamide

Systemtic Name: 3-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-N-cyclopropyl-benzenesulfonamide Openeye Name: 3-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]-N-cyclopropyl-benzenesulfonamide CAS Name: 3-[[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-oxomethyl]-N-cyclopropylbenzenesulfonamide IUPAC Name: 3-[4-(4-chloro-2-nitrophenyl)piperazine-1-carbonyl]-N-cyclopropylbenzenesulfonamide Traditional Name: 3-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]-N-cyclopropyl-benzenesulfonamide Formula: C20H21ClN4O5S MolecularWeight: 464.92254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H21ClN4O5S/c21-15-4-7-18(19(13-15)25(27)28)23-8-10-24(11-9-23)20(26)14-2-1-3-17(12-14)31(29,30)22-16-5-6-16/h1-4,7,12-13,16,22H,5-6,8-11H2