2-[2-(3,5-dimethoxy-4-phenylmethoxy-phenyl)-5-ethyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3,5-dimethoxy-4-phenylmethoxy-phenyl)-5-ethyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-benzyloxy-3,5-dimethoxy-phenyl)-5-ethyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3,5-dimethoxy-4-phenylmethoxyphenyl)-5-ethyl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3,5-dimethoxy-4-phenylmethoxyphenyl)-5-ethyl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-benzoxy-3,5-dimethoxy-phenyl)-5-ethyl-1H-indol-3-yl]acetic acid Formula: C27H27NO5 MolecularWeight: 445.50698

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C(=C3)OC)OCC4=CC=CC=C4)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C(=C3)OC)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C27H27NO5/c1-4-17-10-11-22-20(12-17)21(15-25(29)30)26(28-22)19-13-23(31-2)27(24(14-19)32-3)33-16-18-8-6-5-7-9-18/h5-14,28H,4,15-16H2,1-3H3,(H,29,30)