5-nitro-2-[[(2R)-1-oxidanylbutan-2-yl]amino]pyridin-1-ium-3-carbonitrile

Systemtic Name: 5-nitro-2-[[(2R)-1-oxidanylbutan-2-yl]amino]pyridin-1-ium-3-carbonitrile Openeye Name: 2-[[(1R)-1-(hydroxymethyl)propyl]amino]-5-nitro-pyridin-1-ium-3-carbonitrile CAS Name: 2-[[(2R)-1-hydroxybutan-2-yl]amino]-5-nitro-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-[[(2R)-1-hydroxybutan-2-yl]amino]-5-nitropyridin-1-ium-3-carbonitrile Traditional Name: 2-[[(1R)-1-methylolpropyl]amino]-5-nitro-pyridin-1-ium-3-carbonitrile Formula: C10H13N4O3+ MolecularWeight: 237.23522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=[NH+]C=C(C=C1C#N)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](CO)NC1=[NH+]C=C(C=C1C#N)[N+](=O)[O-]

InChI

InChI=1S/C10H12N4O3/c1-2-8(6-15)13-10-7(4-11)3-9(5-12-10)14(16)17/h3,5,8,15H,2,6H2,1H3,(H,12,13)/p+1/t8-/m1/s1