2-[[(2R)-2,3-bis(oxidanyl)propyl]amino]-5-nitro-pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-[[(2R)-2,3-bis(oxidanyl)propyl]amino]-5-nitro-pyridin-1-ium-3-carbonitrile Openeye Name: 2-[[(2R)-2,3-dihydroxypropyl]amino]-5-nitro-pyridin-1-ium-3-carbonitrile CAS Name: 2-[[(2R)-2,3-dihydroxypropyl]amino]-5-nitro-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-[[(2R)-2,3-dihydroxypropyl]amino]-5-nitropyridin-1-ium-3-carbonitrile Traditional Name: 2-[[(2R)-2,3-dihydroxypropyl]amino]-5-nitro-pyridin-1-ium-3-carbonitrile Formula: C9H11N4O4+ MolecularWeight: 239.20804

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=[NH+]C=C1[N+](=O)[O-])NCC(CO)O)C#N

Isomeric SMILES

C1=C(C(=[NH+]C=C1[N+](=O)[O-])NC[C@H](CO)O)C#N

InChI

InChI=1S/C9H10N4O4/c10-2-6-1-7(13(16)17)3-11-9(6)12-4-8(15)5-14/h1,3,8,14-15H,4-5H2,(H,11,12)/p+1/t8-/m1/s1