[6,7-dimethoxy-1-methyl-4-(propanoylamino)isoquinolin-3-yl] propanoate

Systemtic Name: [6,7-dimethoxy-1-methyl-4-(propanoylamino)isoquinolin-3-yl] propanoate Openeye Name: [6,7-dimethoxy-1-methyl-4-(propanoylamino)-3-isoquinolyl] propanoate CAS Name: propanoic acid [6,7-dimethoxy-1-methyl-4-(1-oxopropylamino)-3-isoquinolinyl] ester IUPAC Name: [6,7-dimethoxy-1-methyl-4-(propanoylamino)isoquinolin-3-yl] propanoate Traditional Name: propionic acid (6,7-dimethoxy-1-methyl-4-propionamido-3-isoquinolyl) ester Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O5/c1-6-15(21)20-17-12-9-14(24-5)13(23-4)8-11(12)10(3)19-18(17)25-16(22)7-2/h8-9H,6-7H2,1-5H3,(H,20,21)