4-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-nitro-benzenesulfonamide Openeye Name: 4-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-nitro-benzenesulfonamide CAS Name: 4-[4-(2-ethoxyphenyl)-1-piperazinyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-nitrobenzenesulfonamide Traditional Name: 3-nitro-4-(4-o-phenetylpiperazino)benzenesulfonamide Formula: C18H22N4O5S MolecularWeight: 406.45608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O5S/c1-2-27-18-6-4-3-5-16(18)21-11-9-20(10-12-21)15-8-7-14(28(19,25)26)13-17(15)22(23)24/h3-8,13H,2,9-12H2,1H3,(H2,19,25,26)