2-[(2S)-2-methylpiperidin-1-yl]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[(2S)-2-methylpiperidin-1-yl]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(2S)-2-methyl-1-piperidyl]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(2S)-2-methyl-1-piperidinyl]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(2S)-2-methylpiperidin-1-yl]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(2S)-2-methylpiperidino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C14H17N4O3+ MolecularWeight: 289.30978

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=C(C(=O)[N+]3=CC=CC=C3N2)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCCN1C2=C(C(=O)[N+]3=CC=CC=C3N2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O3/c1-10-6-2-4-8-16(10)13-12(18(20)21)14(19)17-9-5-3-7-11(17)15-13/h3,5,7,9-10H,2,4,6,8H2,1H3/p+1/t10-/m0/s1