4-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[(3-methoxyphenyl)sulfamoyl]benzoate

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[(3-methoxyphenyl)sulfamoyl]benzoate Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[(3-methoxyphenyl)sulfamoyl]benzoate CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[(3-methoxyphenyl)sulfamoyl]benzoate IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[(3-methoxyphenyl)sulfamoyl]benzoate Traditional Name: 4-(homoveratrylamino)-3-[(3-methoxyphenyl)sulfamoyl]benzoate Formula: C24H25N2O7S- MolecularWeight: 485.5295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=C(C=C(C=C2)C(=O)[O-])S(=O)(=O)NC3=CC(=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=C(C=C(C=C2)C(=O)[O-])S(=O)(=O)NC3=CC(=CC=C3)OC)OC

InChI

InChI=1S/C24H26N2O7S/c1-31-19-6-4-5-18(15-19)26-34(29,30)23-14-17(24(27)28)8-9-20(23)25-12-11-16-7-10-21(32-2)22(13-16)33-3/h4-10,13-15,25-26H,11-12H2,1-3H3,(H,27,28)/p-1