[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 3-quinolin-2-ylpropanoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 3-quinolin-2-ylpropanoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 3-(2-quinolyl)propanoate CAS Name: 3-(2-quinolinyl)propanoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 3-quinolin-2-ylpropanoate Traditional Name: 3-(2-quinolyl)propionic acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)CCC2=NC3=CC=CC=C3C=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)CCC2=NC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C22H21NO3/c1-15-7-8-18(13-16(15)2)21(24)14-26-22(25)12-11-19-10-9-17-5-3-4-6-20(17)23-19/h3-10,13H,11-12,14H2,1-2H3