4-[2-[(3,4-dimethoxyphenyl)sulfonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[(3,4-dimethoxyphenyl)sulfonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(3,4-dimethoxyphenyl)sulfonylamino]ethyl]benzoic acid CAS Name: 4-[2-[(3,4-dimethoxyphenyl)sulfonylamino]ethyl]benzoic acid IUPAC Name: 4-[2-[(3,4-dimethoxyphenyl)sulfonylamino]ethyl]benzoic acid Traditional Name: 4-[2-[(3,4-dimethoxyphenyl)sulfonylamino]ethyl]benzoic acid Formula: C17H19NO6S MolecularWeight: 365.40086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C17H19NO6S/c1-23-15-8-7-14(11-16(15)24-2)25(21,22)18-10-9-12-3-5-13(6-4-12)17(19)20/h3-8,11,18H,9-10H2,1-2H3,(H,19,20)