2-[7-bromanyl-4-(4-methoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-a]pyrimidin-2-yl]cyclopropane-1-carboxylic acid

Systemtic Name: 2-[7-bromanyl-4-(4-methoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-a]pyrimidin-2-yl]cyclopropane-1-carboxylic acid Openeye Name: 2-[7-bromo-4-(4-methoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-a]pyrimidin-2-yl]cyclopropanecarboxylic acid CAS Name: 2-[7-bromo-4-(4-methoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-a]pyrimidin-2-yl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-[7-bromo-4-(4-methoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-a]pyrimidin-2-yl]cyclopropane-1-carboxylic acid Traditional Name: 2-[7-bromo-4-(4-methoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-a]pyrimidin-2-yl]cyclopropanecarboxylic acid Formula: C18H18BrN3O3 MolecularWeight: 404.25782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(N=C3N2C=C(C=N3)Br)C4CC4C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(N=C3N2C=C(C=N3)Br)C4CC4C(=O)O

InChI

InChI=1S/C18H18BrN3O3/c1-25-12-4-2-10(3-5-12)16-7-15(13-6-14(13)17(23)24)21-18-20-8-11(19)9-22(16)18/h2-5,8-9,13-16H,6-7H2,1H3,(H,23,24)