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

Systemtic Name: 3-indol-1-yl-2-(3-methoxy-4-phenylmethoxy-phenyl)-2-(3-methyl-5-phenylmethoxy-phenoxy)propanoic acid Openeye Name: 2-(4-benzyloxy-3-methoxy-phenyl)-2-(3-benzyloxy-5-methyl-phenoxy)-3-indol-1-yl-propanoic acid CAS Name: 3-(1-indolyl)-2-(3-methoxy-4-phenylmethoxyphenyl)-2-(3-methyl-5-phenylmethoxyphenoxy)propanoic acid IUPAC Name: 3-indol-1-yl-2-(3-methoxy-4-phenylmethoxyphenyl)-2-(3-methyl-5-phenylmethoxyphenoxy)propanoic acid Traditional Name: 2-(4-benzoxy-3-methoxy-phenyl)-2-(3-benzoxy-5-methyl-phenoxy)-3-indol-1-yl-propionic acid Formula: C39H35NO6 MolecularWeight: 613.6983

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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)OC)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)OC)C(=O)O)OCC6=CC=CC=C6

InChI

InChI=1S/C39H35NO6/c1-28-21-33(44-25-29-11-5-3-6-12-29)24-34(22-28)46-39(38(41)42,27-40-20-19-31-15-9-10-16-35(31)40)32-17-18-36(37(23-32)43-2)45-26-30-13-7-4-8-14-30/h3-24H,25-27H2,1-2H3,(H,41,42)