2-(3-ethyl-5-phenylmethoxy-phenoxy)-3-indol-1-yl-2-(4-phenylmethoxyphenyl)propanoic acid

Systemtic Name: 2-(3-ethyl-5-phenylmethoxy-phenoxy)-3-indol-1-yl-2-(4-phenylmethoxyphenyl)propanoic acid Openeye Name: 2-(3-benzyloxy-5-ethyl-phenoxy)-2-(4-benzyloxyphenyl)-3-indol-1-yl-propanoic acid CAS Name: 2-(3-ethyl-5-phenylmethoxyphenoxy)-3-(1-indolyl)-2-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-(3-ethyl-5-phenylmethoxyphenoxy)-3-indol-1-yl-2-(4-phenylmethoxyphenyl)propanoic acid Traditional Name: 2-(3-benzoxy-5-ethyl-phenoxy)-2-(4-benzoxyphenyl)-3-indol-1-yl-propionic acid Formula: C39H35NO5 MolecularWeight: 597.6989

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1)OC(CN2C=CC3=CC=CC=C32)(C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)O)OCC6=CC=CC=C6

Isomeric SMILES

CCC1=CC(=CC(=C1)OC(CN2C=CC3=CC=CC=C32)(C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)O)OCC6=CC=CC=C6

InChI

InChI=1S/C39H35NO5/c1-2-29-23-35(44-27-31-13-7-4-8-14-31)25-36(24-29)45-39(38(41)42,28-40-22-21-32-15-9-10-16-37(32)40)33-17-19-34(20-18-33)43-26-30-11-5-3-6-12-30/h3-25H,2,26-28H2,1H3,(H,41,42)