1-(1,3-benzodioxol-5-ylmethyl)-5,6-dimethoxy-3-[(3-methoxyphenyl)sulfamoyl]indole-2-carboxylic acid

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-5,6-dimethoxy-3-[(3-methoxyphenyl)sulfamoyl]indole-2-carboxylic acid Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-5,6-dimethoxy-3-[(3-methoxyphenyl)sulfamoyl]indole-2-carboxylic acid CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-5,6-dimethoxy-3-[(3-methoxyphenyl)sulfamoyl]-2-indolecarboxylic acid IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-5,6-dimethoxy-3-[(3-methoxyphenyl)sulfamoyl]indole-2-carboxylic acid Traditional Name: 5,6-dimethoxy-3-[(3-methoxyphenyl)sulfamoyl]-1-piperonyl-indole-2-carboxylic acid Formula: C26H24N2O9S MolecularWeight: 540.54176

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NS(=O)(=O)C2=C(N(C3=CC(=C(C=C32)OC)OC)CC4=CC5=C(C=C4)OCO5)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)NS(=O)(=O)C2=C(N(C3=CC(=C(C=C32)OC)OC)CC4=CC5=C(C=C4)OCO5)C(=O)O

InChI

InChI=1S/C26H24N2O9S/c1-33-17-6-4-5-16(10-17)27-38(31,32)25-18-11-21(34-2)22(35-3)12-19(18)28(24(25)26(29)30)13-15-7-8-20-23(9-15)37-14-36-20/h4-12,27H,13-14H2,1-3H3,(H,29,30)