(3R)-1-[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-[(2-chloro-3-pyridyl)amino]-2-oxo-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-[(2-chloro-3-pyridinyl)amino]-2-oxoethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-[(2-chloro-3-pyridyl)amino]-2-keto-ethyl]piperidin-1-ium-3-carboxamide Formula: C13H18ClN4O2+ MolecularWeight: 297.76062

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(=O)NC2=C(N=CC=C2)Cl)C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC(=O)NC2=C(N=CC=C2)Cl)C(=O)N

InChI

InChI=1S/C13H17ClN4O2/c14-12-10(4-1-5-16-12)17-11(19)8-18-6-2-3-9(7-18)13(15)20/h1,4-5,9H,2-3,6-8H2,(H2,15,20)(H,17,19)/p+1/t9-/m1/s1