N-[(2S)-butan-2-yl]-4-oxidanyl-2-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-4-oxidanyl-2-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: 4-hydroxy-N-[(1S)-1-methylpropyl]-2-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: N-[(2S)-butan-2-yl]-4-hydroxy-2-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: N-[(2S)-butan-2-yl]-4-hydroxy-2-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: 4-hydroxy-2-keto-N-[(1S)-1-methylpropyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C13H16N3O3+ MolecularWeight: 262.28444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C([N+]2=CC=CC=C2NC1=O)O

Isomeric SMILES

CC[C@H](C)NC(=O)C1=C([N+]2=CC=CC=C2NC1=O)O

InChI

InChI=1S/C13H15N3O3/c1-3-8(2)14-11(17)10-12(18)15-9-6-4-5-7-16(9)13(10)19/h4-8H,3H2,1-2H3,(H2,14,17,18,19)/p+1/t8-/m0/s1