4-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethoxy]benzenesulfonamide

Systemtic Name: 4-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethoxy]benzenesulfonamide Traditional Name: 4-[2-[4-(3-nitrophenyl)sulfonylpiperazino]ethoxy]benzenesulfonamide Formula: C18H22N4O7S2 MolecularWeight: 470.51988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=C(C=C2)S(=O)(=O)N)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCOC2=CC=C(C=C2)S(=O)(=O)N)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O7S2/c19-30(25,26)17-6-4-16(5-7-17)29-13-12-20-8-10-21(11-9-20)31(27,28)18-3-1-2-15(14-18)22(23)24/h1-7,14H,8-13H2,(H2,19,25,26)