4-[2-(4-ethoxy-3-methoxy-phenyl)ethanoylamino]benzenesulfonate

Systemtic Name: 4-[2-(4-ethoxy-3-methoxy-phenyl)ethanoylamino]benzenesulfonate Openeye Name: 4-[[2-(4-ethoxy-3-methoxy-phenyl)acetyl]amino]benzenesulfonate CAS Name: 4-[[2-(4-ethoxy-3-methoxyphenyl)-1-oxoethyl]amino]benzenesulfonate IUPAC Name: 4-[[2-(4-ethoxy-3-methoxyphenyl)acetyl]amino]benzenesulfonate Traditional Name: 4-[[2-(4-ethoxy-3-methoxy-phenyl)acetyl]amino]besylate Formula: C17H18NO6S- MolecularWeight: 364.39292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)[O-])OC

InChI

InChI=1S/C17H19NO6S/c1-3-24-15-9-4-12(10-16(15)23-2)11-17(19)18-13-5-7-14(8-6-13)25(20,21)22/h4-10H,3,11H2,1-2H3,(H,18,19)(H,20,21,22)/p-1