2-[2-(3,4-diethoxyphenyl)-7-ethyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3,4-diethoxyphenyl)-7-ethyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(3,4-diethoxyphenyl)-7-ethyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3,4-diethoxyphenyl)-7-ethyl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3,4-diethoxyphenyl)-7-ethyl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(3,4-diethoxyphenyl)-7-ethyl-1H-indol-3-yl]acetic acid Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC(=C2CC(=O)O)C3=CC(=C(C=C3)OCC)OCC

Isomeric SMILES

CCC1=CC=CC2=C1NC(=C2CC(=O)O)C3=CC(=C(C=C3)OCC)OCC

InChI

InChI=1S/C22H25NO4/c1-4-14-8-7-9-16-17(13-20(24)25)22(23-21(14)16)15-10-11-18(26-5-2)19(12-15)27-6-3/h7-12,23H,4-6,13H2,1-3H3,(H,24,25)