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

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Openeye Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one IUPAC Name: 2-(4-bromo-2,6-dimethylphenoxy)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-9,10-dimethoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-4-one Formula: C22H21BrN2O4 MolecularWeight: 457.31714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=NC(=O)N3CCC4=CC(=C(C=C4C3=C2)OC)OC)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC2=NC(=O)N3CCC4=CC(=C(C=C4C3=C2)OC)OC)C)Br

InChI

InChI=1S/C22H21BrN2O4/c1-12-7-15(23)8-13(2)21(12)29-20-11-17-16-10-19(28-4)18(27-3)9-14(16)5-6-25(17)22(26)24-20/h7-11H,5-6H2,1-4H3