2-[2-(3-ethoxy-4-phenylmethoxy-phenyl)-4,7-dimethyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3-ethoxy-4-phenylmethoxy-phenyl)-4,7-dimethyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-benzyloxy-3-ethoxy-phenyl)-4,7-dimethyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3-ethoxy-4-phenylmethoxyphenyl)-4,7-dimethyl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3-ethoxy-4-phenylmethoxyphenyl)-4,7-dimethyl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-benzoxy-3-ethoxy-phenyl)-4,7-dimethyl-1H-indol-3-yl]acetic acid Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=C(C3=C(C=CC(=C3N2)C)C)CC(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=C(C3=C(C=CC(=C3N2)C)C)CC(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H27NO4/c1-4-31-23-14-20(12-13-22(23)32-16-19-8-6-5-7-9-19)27-21(15-24(29)30)25-17(2)10-11-18(3)26(25)28-27/h5-14,28H,4,15-16H2,1-3H3,(H,29,30)