N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-nitro-benzenesulfonamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-nitro-benzenesulfonamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-nitrobenzenesulfonamide Traditional Name: N-[3-[4-(4-methoxyphenyl)piperazino]propyl]-2-nitro-benzenesulfonamide Formula: C20H26N4O5S MolecularWeight: 434.50924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCCNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCCNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O5S/c1-29-18-9-7-17(8-10-18)23-15-13-22(14-16-23)12-4-11-21-30(27,28)20-6-3-2-5-19(20)24(25)26/h2-3,5-10,21H,4,11-16H2,1H3