2-(7-bromanyl-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(3,4-dimethoxyphenyl)cyclohexa-1,5-diene-1-carbaldehyde

Systemtic Name: 2-(7-bromanyl-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(3,4-dimethoxyphenyl)cyclohexa-1,5-diene-1-carbaldehyde Openeye Name: 2-(7-bromo-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(3,4-dimethoxyphenyl)cyclohexa-1,5-diene-1-carbaldehyde CAS Name: 2-(7-bromo-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(3,4-dimethoxyphenyl)-1-cyclohexa-1,5-dienecarboxaldehyde IUPAC Name: 2-(7-bromo-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(3,4-dimethoxyphenyl)cyclohexa-1,5-diene-1-carbaldehyde Traditional Name: 2-(7-bromo-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(3,4-dimethoxyphenyl)cyclohexa-1,5-diene-1-carbaldehyde Formula: C22H20BrN3O3 MolecularWeight: 454.3165

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=C(C=C2)C=O)C3C=CN4C=C(C=NC4=N3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=C(C=C2)C=O)C3C=CN4C=C(C=NC4=N3)Br)OC

InChI

InChI=1S/C22H20BrN3O3/c1-28-20-6-5-15(10-21(20)29-2)14-3-4-16(13-27)18(9-14)19-7-8-26-12-17(23)11-24-22(26)25-19/h3-8,10-14,19H,9H2,1-2H3