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

Systemtic Name: 3-(carboxymethyl)-2-(3-methoxy-4-phenylmethoxy-phenyl)-1H-indole-5-carboxylic acid Openeye Name: 2-(4-benzyloxy-3-methoxy-phenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid CAS Name: 3-(carboxymethyl)-2-(3-methoxy-4-phenylmethoxyphenyl)-1H-indole-5-carboxylic acid IUPAC Name: 3-(carboxymethyl)-2-(3-methoxy-4-phenylmethoxyphenyl)-1H-indole-5-carboxylic acid Traditional Name: 2-(4-benzoxy-3-methoxy-phenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid Formula: C25H21NO6 MolecularWeight: 431.43734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CC(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CC(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H21NO6/c1-31-22-12-16(8-10-21(22)32-14-15-5-3-2-4-6-15)24-19(13-23(27)28)18-11-17(25(29)30)7-9-20(18)26-24/h2-12,26H,13-14H2,1H3,(H,27,28)(H,29,30)