3-nitro-4-(3-piperidin-1-ylpropylamino)-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 3-nitro-4-(3-piperidin-1-ylpropylamino)-N-propan-2-yl-benzenesulfonamide Openeye Name: N-isopropyl-3-nitro-4-[3-(1-piperidyl)propylamino]benzenesulfonamide CAS Name: 3-nitro-4-[3-(1-piperidinyl)propylamino]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 3-nitro-4-(3-piperidin-1-ylpropylamino)-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-3-nitro-4-(3-piperidinopropylamino)benzenesulfonamide Formula: C17H28N4O4S MolecularWeight: 384.49362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCCN2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCCN2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C17H28N4O4S/c1-14(2)19-26(24,25)15-7-8-16(17(13-15)21(22)23)18-9-6-12-20-10-4-3-5-11-20/h7-8,13-14,18-19H,3-6,9-12H2,1-2H3