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

Systemtic Name: 2-[5-ethoxy-2-(2,4,5-trimethoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-ethoxy-2-(2,4,5-trimethoxyphenyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[5-ethoxy-2-(2,4,5-trimethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-ethoxy-2-(2,4,5-trimethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-(2-asaryl-5-ethoxy-1H-indol-3-yl)acetic acid Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3OC)OC)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3OC)OC)OC

InChI

InChI=1S/C21H23NO6/c1-5-28-12-6-7-16-13(8-12)14(10-20(23)24)21(22-16)15-9-18(26-3)19(27-4)11-17(15)25-2/h6-9,11,22H,5,10H2,1-4H3,(H,23,24)