(2-aminocarbonylphenyl) 4-(4-ethoxyphenoxy)benzenesulfonate

Systemtic Name: (2-aminocarbonylphenyl) 4-(4-ethoxyphenoxy)benzenesulfonate Openeye Name: (2-carbamoylphenyl) 4-(4-ethoxyphenoxy)benzenesulfonate CAS Name: 4-(4-ethoxyphenoxy)benzenesulfonic acid (2-carbamoylphenyl) ester IUPAC Name: (2-carbamoylphenyl) 4-(4-ethoxyphenoxy)benzenesulfonate Traditional Name: 4-(4-ethoxyphenoxy)benzenesulfonic acid (2-carbamoylphenyl) ester Formula: C21H19NO6S MolecularWeight: 413.44366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)OC3=CC=CC=C3C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)OC3=CC=CC=C3C(=O)N

InChI

InChI=1S/C21H19NO6S/c1-2-26-15-7-9-16(10-8-15)27-17-11-13-18(14-12-17)29(24,25)28-20-6-4-3-5-19(20)21(22)23/h3-14H,2H2,1H3,(H2,22,23)