3-[2-(2,5-dimethylphenyl)-1H-indol-3-yl]propanoate

Systemtic Name: 3-[2-(2,5-dimethylphenyl)-1H-indol-3-yl]propanoate Openeye Name: 3-[2-(2,5-dimethylphenyl)-1H-indol-3-yl]propanoate CAS Name: 3-[2-(2,5-dimethylphenyl)-1H-indol-3-yl]propanoate IUPAC Name: 3-[2-(2,5-dimethylphenyl)-1H-indol-3-yl]propanoate Traditional Name: 3-[2-(2,5-dimethylphenyl)-1H-indol-3-yl]propionate Formula: C19H18NO2- MolecularWeight: 292.35172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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