3-(carboxymethyl)-2-(4-ethoxy-3-methoxy-phenyl)-1H-indole-5-carboxylic acid

Systemtic Name: 3-(carboxymethyl)-2-(4-ethoxy-3-methoxy-phenyl)-1H-indole-5-carboxylic acid Openeye Name: 3-(carboxymethyl)-2-(4-ethoxy-3-methoxy-phenyl)-1H-indole-5-carboxylic acid CAS Name: 3-(carboxymethyl)-2-(4-ethoxy-3-methoxyphenyl)-1H-indole-5-carboxylic acid IUPAC Name: 3-(carboxymethyl)-2-(4-ethoxy-3-methoxyphenyl)-1H-indole-5-carboxylic acid Traditional Name: 3-(carboxymethyl)-2-(4-ethoxy-3-methoxy-phenyl)-1H-indole-5-carboxylic acid Formula: C20H19NO6 MolecularWeight: 369.36796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CC(=O)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CC(=O)O)OC

InChI

InChI=1S/C20H19NO6/c1-3-27-16-7-5-11(9-17(16)26-2)19-14(10-18(22)23)13-8-12(20(24)25)4-6-15(13)21-19/h4-9,21H,3,10H2,1-2H3,(H,22,23)(H,24,25)