2-[2-(2-hydroxyphenyl)-2-oxidanylidene-ethoxy]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one

Systemtic Name: 2-[2-(2-hydroxyphenyl)-2-oxidanylidene-ethoxy]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Openeye Name: 2-[2-(2-hydroxyphenyl)-2-oxo-ethoxy]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one CAS Name: 2-[2-(2-hydroxyphenyl)-2-oxoethoxy]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one IUPAC Name: 2-[2-(2-hydroxyphenyl)-2-oxoethoxy]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Traditional Name: 2-[2-(2-hydroxyphenyl)-2-keto-ethoxy]-9,10-dimethoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-4-one Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)OCC(=O)C4=CC=CC=C4O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)OCC(=O)C4=CC=CC=C4O)OC

InChI

InChI=1S/C22H20N2O6/c1-28-19-9-13-7-8-24-16(15(13)10-20(19)29-2)11-21(23-22(24)27)30-12-18(26)14-5-3-4-6-17(14)25/h3-6,9-11,25H,7-8,12H2,1-2H3