[3-(4-methylphenyl)isoquinolin-1-yl] N,N-diethylcarbamate

Systemtic Name: [3-(4-methylphenyl)isoquinolin-1-yl] N,N-diethylcarbamate Openeye Name: [3-(p-tolyl)-1-isoquinolyl] N,N-diethylcarbamate CAS Name: N,N-diethylcarbamic acid [3-(4-methylphenyl)-1-isoquinolinyl] ester IUPAC Name: [3-(4-methylphenyl)isoquinolin-1-yl] N,N-diethylcarbamate Traditional Name: N,N-diethylcarbamic acid [3-(p-tolyl)-1-isoquinolyl] ester Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)OC1=NC(=CC2=CC=CC=C21)C3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)C(=O)OC1=NC(=CC2=CC=CC=C21)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H22N2O2/c1-4-23(5-2)21(24)25-20-18-9-7-6-8-17(18)14-19(22-20)16-12-10-15(3)11-13-16/h6-14H,4-5H2,1-3H3