(3R)-1-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[(7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[(7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[(7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[(7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-1-ium-3-carboxamide Formula: C15H18BrN4O2+ MolecularWeight: 366.23302

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC(=O)N3C=C(C=CC3=N2)Br)C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC2=CC(=O)N3C=C(C=CC3=N2)Br)C(=O)N

InChI

InChI=1S/C15H17BrN4O2/c16-11-3-4-13-18-12(6-14(21)20(13)8-11)9-19-5-1-2-10(7-19)15(17)22/h3-4,6,8,10H,1-2,5,7,9H2,(H2,17,22)/p+1/t10-/m1/s1