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

Systemtic Name: 2-[5-ethoxy-2-(4-phenylmethoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-benzyloxyphenyl)-5-ethoxy-1H-indol-3-yl]acetic acid CAS Name: 2-[5-ethoxy-2-(4-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-ethoxy-2-(4-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-benzoxyphenyl)-5-ethoxy-1H-indol-3-yl]acetic acid Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H23NO4/c1-2-29-20-12-13-23-21(14-20)22(15-24(27)28)25(26-23)18-8-10-19(11-9-18)30-16-17-6-4-3-5-7-17/h3-14,26H,2,15-16H2,1H3,(H,27,28)