3-(2,6-dimethyl-1H-indol-3-yl)propanoate

Systemtic Name: 3-(2,6-dimethyl-1H-indol-3-yl)propanoate Openeye Name: 3-(2,6-dimethyl-1H-indol-3-yl)propanoate CAS Name: 3-(2,6-dimethyl-1H-indol-3-yl)propanoate IUPAC Name: 3-(2,6-dimethyl-1H-indol-3-yl)propanoate Traditional Name: 3-(2,6-dimethyl-1H-indol-3-yl)propionate Formula: C13H14NO2- MolecularWeight: 216.25576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N2)C)CCC(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N2)C)CCC(=O)[O-]

InChI

InChI=1S/C13H15NO2/c1-8-3-4-11-10(5-6-13(15)16)9(2)14-12(11)7-8/h3-4,7,14H,5-6H2,1-2H3,(H,15,16)/p-1