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

Systemtic Name: 3-indol-1-yl-2-(3-methyl-5-phenylmethoxy-phenoxy)-2-(4-phenylmethoxyphenyl)propanoic acid Openeye Name: 2-(3-benzyloxy-5-methyl-phenoxy)-2-(4-benzyloxyphenyl)-3-indol-1-yl-propanoic acid CAS Name: 3-(1-indolyl)-2-(3-methyl-5-phenylmethoxyphenoxy)-2-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 3-indol-1-yl-2-(3-methyl-5-phenylmethoxyphenoxy)-2-(4-phenylmethoxyphenyl)propanoic acid Traditional Name: 2-(3-benzoxy-5-methyl-phenoxy)-2-(4-benzoxyphenyl)-3-indol-1-yl-propionic acid Formula: C38H33NO5 MolecularWeight: 583.67232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=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

CC1=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/C38H33NO5/c1-28-22-34(43-26-30-12-6-3-7-13-30)24-35(23-28)44-38(37(40)41,27-39-21-20-31-14-8-9-15-36(31)39)32-16-18-33(19-17-32)42-25-29-10-4-2-5-11-29/h2-24H,25-27H2,1H3,(H,40,41)