2-[5-ethyl-2-(3-methoxy-4-phenylmethoxy-phenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-ethyl-2-(3-methoxy-4-phenylmethoxy-phenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-benzyloxy-3-methoxy-phenyl)-5-ethyl-1H-indol-3-yl]acetic acid CAS Name: 2-[5-ethyl-2-(3-methoxy-4-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-ethyl-2-(3-methoxy-4-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-benzoxy-3-methoxy-phenyl)-5-ethyl-1H-indol-3-yl]acetic acid Formula: C26H25NO4 MolecularWeight: 415.481

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C26H25NO4/c1-3-17-9-11-22-20(13-17)21(15-25(28)29)26(27-22)19-10-12-23(24(14-19)30-2)31-16-18-7-5-4-6-8-18/h4-14,27H,3,15-16H2,1-2H3,(H,28,29)