[8-chloranyl-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-5-yl] N,N-dimethylcarbamate

Systemtic Name: [8-chloranyl-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-5-yl] N,N-dimethylcarbamate Openeye Name: [8-chloro-2-(4-pyridylamino)-3,4-dihydro-1H-isoquinolin-5-yl] N,N-dimethylcarbamate CAS Name: N,N-dimethylcarbamic acid [8-chloro-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-5-yl] ester IUPAC Name: [8-chloro-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-5-yl] N,N-dimethylcarbamate Traditional Name: N,N-dimethylcarbamic acid [8-chloro-2-(4-pyridylamino)-3,4-dihydro-1H-isoquinolin-5-yl] ester Formula: C17H19ClN4O2 MolecularWeight: 346.81136

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC1=C2CCN(CC2=C(C=C1)Cl)NC3=CC=NC=C3

Isomeric SMILES

CN(C)C(=O)OC1=C2CCN(CC2=C(C=C1)Cl)NC3=CC=NC=C3

InChI

InChI=1S/C17H19ClN4O2/c1-21(2)17(23)24-16-4-3-15(18)14-11-22(10-7-13(14)16)20-12-5-8-19-9-6-12/h3-6,8-9H,7,10-11H2,1-2H3,(H,19,20)