[1-[(4-cyanophenyl)methyl]-2,2,4-trimethyl-quinolin-6-yl] ethanoate

Systemtic Name: [1-[(4-cyanophenyl)methyl]-2,2,4-trimethyl-quinolin-6-yl] ethanoate Openeye Name: [1-[(4-cyanophenyl)methyl]-2,2,4-trimethyl-6-quinolyl] acetate CAS Name: acetic acid [1-[(4-cyanophenyl)methyl]-2,2,4-trimethyl-6-quinolinyl] ester IUPAC Name: [1-[(4-cyanophenyl)methyl]-2,2,4-trimethylquinolin-6-yl] acetate Traditional Name: acetic acid [1-(4-cyanobenzyl)-2,2,4-trimethyl-6-quinolyl] ester Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C)CC3=CC=C(C=C3)C#N)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C)CC3=CC=C(C=C3)C#N)(C)C

InChI

InChI=1S/C22H22N2O2/c1-15-12-22(3,4)24(14-18-7-5-17(13-23)6-8-18)21-10-9-19(11-20(15)21)26-16(2)25/h5-12H,14H2,1-4H3