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

Systemtic Name: 2-(7-bromanyl-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(4-methoxyphenyl)cyclohexa-1,5-diene-1-carbaldehyde Openeye Name: 2-(7-bromo-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(4-methoxyphenyl)cyclohexa-1,5-diene-1-carbaldehyde CAS Name: 2-(7-bromo-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(4-methoxyphenyl)-1-cyclohexa-1,5-dienecarboxaldehyde IUPAC Name: 2-(7-bromo-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(4-methoxyphenyl)cyclohexa-1,5-diene-1-carbaldehyde Traditional Name: 2-(7-bromo-2H-pyrimido[1,2-a]pyrimidin-2-yl)-4-(4-methoxyphenyl)cyclohexa-1,5-diene-1-carbaldehyde Formula: C21H18BrN3O2 MolecularWeight: 424.29052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrN3O2/c1-27-18-6-4-14(5-7-18)15-2-3-16(13-26)19(10-15)20-8-9-25-12-17(22)11-23-21(25)24-20/h2-9,11-13,15,20H,10H2,1H3