2-(1,3-benzodioxol-5-yl)-2-(6-methoxycarbonyl-1-methyl-indol-3-yl)ethanoic acid

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-(6-methoxycarbonyl-1-methyl-indol-3-yl)ethanoic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-(6-methoxycarbonyl-1-methyl-indol-3-yl)acetic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(6-methoxycarbonyl-1-methyl-3-indolyl)acetic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-(6-methoxycarbonyl-1-methylindol-3-yl)acetic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(6-carbomethoxy-1-methyl-indol-3-yl)acetic acid Formula: C20H17NO6 MolecularWeight: 367.35208

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=C(C=C2)C(=O)OC)C(C3=CC4=C(C=C3)OCO4)C(=O)O

Isomeric SMILES

CN1C=C(C2=C1C=C(C=C2)C(=O)OC)C(C3=CC4=C(C=C3)OCO4)C(=O)O

InChI

InChI=1S/C20H17NO6/c1-21-9-14(13-5-3-12(7-15(13)21)20(24)25-2)18(19(22)23)11-4-6-16-17(8-11)27-10-26-16/h3-9,18H,10H2,1-2H3,(H,22,23)