[4-(4-cyanophenyl)phenyl] 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)ethanoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)ethanoate Openeye Name: [4-(4-cyanophenyl)phenyl] 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)acetate CAS Name: 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)acetic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)acetate Traditional Name: 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)acetic acid [4-(4-cyanophenyl)phenyl] ester Formula: C25H22N2O2 MolecularWeight: 382.45438

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC=CC=C2C1CC(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CN1CCC2=CC=CC=C2C1CC(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H22N2O2/c1-27-15-14-21-4-2-3-5-23(21)24(27)16-25(28)29-22-12-10-20(11-13-22)19-8-6-18(17-26)7-9-19/h2-13,24H,14-16H2,1H3