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

Systemtic Name: 2-[5-cyclohexyloxy-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-(cyclohexoxy)-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[5-cyclohexyloxy-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-cyclohexyloxy-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-(cyclohexoxy)-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]acetic acid Formula: C25H29NO6 MolecularWeight: 439.50086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)OC4CCCCC4)CC(=O)O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)OC4CCCCC4)CC(=O)O)OC)OC

InChI

InChI=1S/C25H29NO6/c1-29-21-12-10-17(24(30-2)25(21)31-3)23-19(14-22(27)28)18-13-16(9-11-20(18)26-23)32-15-7-5-4-6-8-15/h9-13,15,26H,4-8,14H2,1-3H3,(H,27,28)