3-[2-(4-ethylphenyl)-5-methyl-1H-indol-3-yl]propanoate

Systemtic Name: 3-[2-(4-ethylphenyl)-5-methyl-1H-indol-3-yl]propanoate Openeye Name: 3-[2-(4-ethylphenyl)-5-methyl-1H-indol-3-yl]propanoate CAS Name: 3-[2-(4-ethylphenyl)-5-methyl-1H-indol-3-yl]propanoate IUPAC Name: 3-[2-(4-ethylphenyl)-5-methyl-1H-indol-3-yl]propanoate Traditional Name: 3-[2-(4-ethylphenyl)-5-methyl-1H-indol-3-yl]propionate Formula: C20H20NO2- MolecularWeight: 306.3783

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)C)CCC(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)C)CCC(=O)[O-]

InChI

InChI=1S/C20H21NO2/c1-3-14-5-7-15(8-6-14)20-16(9-11-19(22)23)17-12-13(2)4-10-18(17)21-20/h4-8,10,12,21H,3,9,11H2,1-2H3,(H,22,23)/p-1