ethyl (2S)-2-(6-azanyl-5-nitro-pyridin-1-ium-2-yl)oxypropanoate

Systemtic Name: ethyl (2S)-2-(6-azanyl-5-nitro-pyridin-1-ium-2-yl)oxypropanoate Openeye Name: ethyl (2S)-2-(6-amino-5-nitro-pyridin-1-ium-2-yl)oxypropanoate CAS Name: (2S)-2-[(6-amino-5-nitro-2-pyridin-1-iumyl)oxy]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(6-amino-5-nitropyridin-1-ium-2-yl)oxypropanoate Traditional Name: (2S)-2-(6-amino-5-nitro-pyridin-1-ium-2-yl)oxypropionic acid ethyl ester Formula: C10H14N3O5+ MolecularWeight: 256.23526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=[NH+]C(=C(C=C1)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)[C@H](C)OC1=[NH+]C(=C(C=C1)[N+](=O)[O-])N

InChI

InChI=1S/C10H13N3O5/c1-3-17-10(14)6(2)18-8-5-4-7(13(15)16)9(11)12-8/h4-6H,3H2,1-2H3,(H2,11,12)/p+1/t6-/m0/s1