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

Systemtic Name: 2-[5-cyclohexyloxy-2-(3-ethoxy-4-phenylmethoxy-phenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-benzyloxy-3-ethoxy-phenyl)-5-(cyclohexoxy)-1H-indol-3-yl]acetic acid CAS Name: 2-[5-cyclohexyloxy-2-(3-ethoxy-4-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-cyclohexyloxy-2-(3-ethoxy-4-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-benzoxy-3-ethoxy-phenyl)-5-(cyclohexoxy)-1H-indol-3-yl]acetic acid Formula: C31H33NO5 MolecularWeight: 499.59742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)OC4CCCCC4)CC(=O)O)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)OC4CCCCC4)CC(=O)O)OCC5=CC=CC=C5

InChI

InChI=1S/C31H33NO5/c1-2-35-29-17-22(13-16-28(29)36-20-21-9-5-3-6-10-21)31-26(19-30(33)34)25-18-24(14-15-27(25)32-31)37-23-11-7-4-8-12-23/h3,5-6,9-10,13-18,23,32H,2,4,7-8,11-12,19-20H2,1H3,(H,33,34)