3-[2-(3,4-dimethylphenyl)-1H-indol-3-yl]propanoic acid

Systemtic Name: 3-[2-(3,4-dimethylphenyl)-1H-indol-3-yl]propanoic acid Openeye Name: 3-[2-(3,4-dimethylphenyl)-1H-indol-3-yl]propanoic acid CAS Name: 3-[2-(3,4-dimethylphenyl)-1H-indol-3-yl]propanoic acid IUPAC Name: 3-[2-(3,4-dimethylphenyl)-1H-indol-3-yl]propanoic acid Traditional Name: 3-[2-(3,4-dimethylphenyl)-1H-indol-3-yl]propionic acid Formula: C19H19NO2 MolecularWeight: 293.35966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C3=CC=CC=C3N2)CCC(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C3=CC=CC=C3N2)CCC(=O)O)C

InChI

InChI=1S/C19H19NO2/c1-12-7-8-14(11-13(12)2)19-16(9-10-18(21)22)15-5-3-4-6-17(15)20-19/h3-8,11,20H,9-10H2,1-2H3,(H,21,22)