[7-methoxy-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-6-yl] N,N-dimethylcarbamate

Systemtic Name: [7-methoxy-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-6-yl] N,N-dimethylcarbamate Openeye Name: [7-methoxy-2-(4-pyridylamino)-3,4-dihydro-1H-isoquinolin-6-yl] N,N-dimethylcarbamate CAS Name: N,N-dimethylcarbamic acid [7-methoxy-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-6-yl] ester IUPAC Name: [7-methoxy-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-6-yl] N,N-dimethylcarbamate Traditional Name: N,N-dimethylcarbamic acid [7-methoxy-2-(4-pyridylamino)-3,4-dihydro-1H-isoquinolin-6-yl] ester Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC1=C(C=C2CN(CCC2=C1)NC3=CC=NC=C3)OC

Isomeric SMILES

CN(C)C(=O)OC1=C(C=C2CN(CCC2=C1)NC3=CC=NC=C3)OC

InChI

InChI=1S/C18H22N4O3/c1-21(2)18(23)25-17-10-13-6-9-22(12-14(13)11-16(17)24-3)20-15-4-7-19-8-5-15/h4-5,7-8,10-11H,6,9,12H2,1-3H3,(H,19,20)