[(2R)-3-chloranyl-1-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-oxidanylidene-propan-2-yl]carbamic acid

Systemtic Name: [(2R)-3-chloranyl-1-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-oxidanylidene-propan-2-yl]carbamic acid Openeye Name: [(1R)-1-(chloromethyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-2-oxo-ethyl]carbamic acid CAS Name: [(2R)-3-chloro-1-[4-(dimethylamino)-1-pyridin-1-iumyl]-1-oxopropan-2-yl]carbamic acid IUPAC Name: [(2R)-3-chloro-1-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-oxopropan-2-yl]carbamic acid Traditional Name: [(1R)-1-(chloromethyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-2-keto-ethyl]carbamic acid Formula: C11H15ClN3O3+ MolecularWeight: 272.7081

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)C(=O)C(CCl)NC(=O)O

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)C(=O)[C@H](CCl)NC(=O)O

InChI

InChI=1S/C11H14ClN3O3/c1-14(2)8-3-5-15(6-4-8)10(16)9(7-12)13-11(17)18/h3-6,9,13H,7H2,1-2H3/p+1/t9-/m0/s1