3-phenylpropyl-bis[(3-sulfamoylphenyl)methyl]azanium

Systemtic Name: 3-phenylpropyl-bis[(3-sulfamoylphenyl)methyl]azanium Openeye Name: 3-phenylpropyl-bis[(3-sulfamoylphenyl)methyl]ammonium CAS Name: 3-phenylpropyl-bis[(3-sulfamoylphenyl)methyl]ammonium IUPAC Name: 3-phenylpropyl-bis[(3-sulfamoylphenyl)methyl]azanium Traditional Name: 3-phenylpropyl-bis(3-sulfamoylbenzyl)ammonium Formula: C23H28N3O4S2+ MolecularWeight: 474.61612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC[NH+](CC2=CC(=CC=C2)S(=O)(=O)N)CC3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CCC[NH+](CC2=CC(=CC=C2)S(=O)(=O)N)CC3=CC(=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C23H27N3O4S2/c24-31(27,28)22-12-4-9-20(15-22)17-26(14-6-11-19-7-2-1-3-8-19)18-21-10-5-13-23(16-21)32(25,29)30/h1-5,7-10,12-13,15-16H,6,11,14,17-18H2,(H2,24,27,28)(H2,25,29,30)/p+1