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

Systemtic Name: [(2R)-1-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-oxidanylidene-propan-2-yl]carbamic acid Openeye Name: [(1R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-methyl-2-oxo-ethyl]carbamic acid CAS Name: [(2R)-1-[4-(dimethylamino)-1-pyridin-1-iumyl]-1-oxopropan-2-yl]carbamic acid IUPAC Name: [(2R)-1-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-oxopropan-2-yl]carbamic acid Traditional Name: [(1R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-2-keto-1-methyl-ethyl]carbamic acid Formula: C11H16N3O3+ MolecularWeight: 238.26304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[N+]1=CC=C(C=C1)N(C)C)NC(=O)O

Isomeric SMILES

C[C@H](C(=O)[N+]1=CC=C(C=C1)N(C)C)NC(=O)O

InChI

InChI=1S/C11H15N3O3/c1-8(12-11(16)17)10(15)14-6-4-9(5-7-14)13(2)3/h4-8,12H,1-3H3/p+1/t8-/m1/s1