(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl-cyclooctyl-azanium

Systemtic Name: (7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl-cyclooctyl-azanium Openeye Name: (7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl-cyclooctyl-ammonium CAS Name: (7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl-cyclooctylammonium IUPAC Name: (7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl-cyclooctylazanium Traditional Name: (7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl-cyclooctyl-ammonium Formula: C17H23BrN3O+ MolecularWeight: 365.28802

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)[NH2+]CC2=CC(=O)N3C=C(C=CC3=N2)Br

Isomeric SMILES

C1CCCC(CCC1)[NH2+]CC2=CC(=O)N3C=C(C=CC3=N2)Br

InChI

InChI=1S/C17H22BrN3O/c18-13-8-9-16-20-15(10-17(22)21(16)12-13)11-19-14-6-4-2-1-3-5-7-14/h8-10,12,14,19H,1-7,11H2/p+1