3-[2-(2,4-dimethoxyphenyl)-5-methyl-1H-indol-3-yl]propanoic acid

Systemtic Name: 3-[2-(2,4-dimethoxyphenyl)-5-methyl-1H-indol-3-yl]propanoic acid Openeye Name: 3-[2-(2,4-dimethoxyphenyl)-5-methyl-1H-indol-3-yl]propanoic acid CAS Name: 3-[2-(2,4-dimethoxyphenyl)-5-methyl-1H-indol-3-yl]propanoic acid IUPAC Name: 3-[2-(2,4-dimethoxyphenyl)-5-methyl-1H-indol-3-yl]propanoic acid Traditional Name: 3-[2-(2,4-dimethoxyphenyl)-5-methyl-1H-indol-3-yl]propionic acid Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CCC(=O)O)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CCC(=O)O)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C20H21NO4/c1-12-4-8-17-16(10-12)14(7-9-19(22)23)20(21-17)15-6-5-13(24-2)11-18(15)25-3/h4-6,8,10-11,21H,7,9H2,1-3H3,(H,22,23)