[4-(butylcarbamoylamino)-6,7-dimethoxy-1-methyl-isoquinolin-3-yl] N,N-diethylcarbamate

Systemtic Name: [4-(butylcarbamoylamino)-6,7-dimethoxy-1-methyl-isoquinolin-3-yl] N,N-diethylcarbamate Openeye Name: [4-(butylcarbamoylamino)-6,7-dimethoxy-1-methyl-3-isoquinolyl] N,N-diethylcarbamate CAS Name: N,N-diethylcarbamic acid [4-[[butylamino(oxo)methyl]amino]-6,7-dimethoxy-1-methyl-3-isoquinolinyl] ester IUPAC Name: [4-(butylcarbamoylamino)-6,7-dimethoxy-1-methylisoquinolin-3-yl] N,N-diethylcarbamate Traditional Name: N,N-diethylcarbamic acid [4-(butylcarbamoylamino)-6,7-dimethoxy-1-methyl-3-isoquinolyl] ester Formula: C22H32N4O5 MolecularWeight: 432.51328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=C(N=C(C2=CC(=C(C=C21)OC)OC)C)OC(=O)N(CC)CC

Isomeric SMILES

CCCCNC(=O)NC1=C(N=C(C2=CC(=C(C=C21)OC)OC)C)OC(=O)N(CC)CC

InChI

InChI=1S/C22H32N4O5/c1-7-10-11-23-21(27)25-19-16-13-18(30-6)17(29-5)12-15(16)14(4)24-20(19)31-22(28)26(8-2)9-3/h12-13H,7-11H2,1-6H3,(H2,23,25,27)