9,10-dimethoxy-2-[4-(2-methylbutan-2-yl)phenoxy]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one

Systemtic Name: 9,10-dimethoxy-2-[4-(2-methylbutan-2-yl)phenoxy]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Openeye Name: 2-[4-(1,1-dimethylpropyl)phenoxy]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one CAS Name: 9,10-dimethoxy-2-[4-(2-methylbutan-2-yl)phenoxy]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one IUPAC Name: 9,10-dimethoxy-2-[4-(2-methylbutan-2-yl)phenoxy]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Traditional Name: 2-(4-tert-amylphenoxy)-9,10-dimethoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-4-one Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC2=NC(=O)N3CCC4=CC(=C(C=C4C3=C2)OC)OC

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC2=NC(=O)N3CCC4=CC(=C(C=C4C3=C2)OC)OC

InChI

InChI=1S/C25H28N2O4/c1-6-25(2,3)17-7-9-18(10-8-17)31-23-15-20-19-14-22(30-5)21(29-4)13-16(19)11-12-27(20)24(28)26-23/h7-10,13-15H,6,11-12H2,1-5H3