3-(1-cyano-9,10-dimethoxy-2,4,6,7-tetrahydropyrimido[6,1-a]isoquinolin-3-yl)propanoate

Systemtic Name: 3-(1-cyano-9,10-dimethoxy-2,4,6,7-tetrahydropyrimido[6,1-a]isoquinolin-3-yl)propanoate Openeye Name: 3-(1-cyano-9,10-dimethoxy-2,4,6,7-tetrahydropyrimido[6,1-a]isoquinolin-3-yl)propanoate CAS Name: 3-(1-cyano-9,10-dimethoxy-2,4,6,7-tetrahydropyrimido[6,1-a]isoquinolin-3-yl)propanoate IUPAC Name: 3-(1-cyano-9,10-dimethoxy-2,4,6,7-tetrahydropyrimido[6,1-a]isoquinolin-3-yl)propanoate Traditional Name: 3-(1-cyano-9,10-dimethoxy-2,4,6,7-tetrahydropyrimid[6,1-a]isoquinolin-3-yl)propionate Formula: C18H20N3O4- MolecularWeight: 342.3691

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN3C2=C(CN(C3)CCC(=O)[O-])C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN3C2=C(CN(C3)CCC(=O)[O-])C#N)OC

InChI

InChI=1S/C18H21N3O4/c1-24-15-7-12-3-6-21-11-20(5-4-17(22)23)10-13(9-19)18(21)14(12)8-16(15)25-2/h7-8H,3-6,10-11H2,1-2H3,(H,22,23)/p-1