(4-methanoyl-2,6-dimethoxy-phenyl) 4-acetamidobenzenesulfonate

Systemtic Name: (4-methanoyl-2,6-dimethoxy-phenyl) 4-acetamidobenzenesulfonate Openeye Name: (4-formyl-2,6-dimethoxy-phenyl) 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid (4-formyl-2,6-dimethoxyphenyl) ester IUPAC Name: (4-formyl-2,6-dimethoxyphenyl) 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid (4-formyl-2,6-dimethoxy-phenyl) ester Formula: C17H17NO7S MolecularWeight: 379.38438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2OC)C=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2OC)C=O)OC

InChI

InChI=1S/C17H17NO7S/c1-11(20)18-13-4-6-14(7-5-13)26(21,22)25-17-15(23-2)8-12(10-19)9-16(17)24-3/h4-10H,1-3H3,(H,18,20)