ethyl N-azanyl-N-[1-(2-oxidanylidene-2-thiophen-2-yl-ethyl)pyridin-1-ium-3-yl]carbonyl-carbamate

Systemtic Name: ethyl N-azanyl-N-[1-(2-oxidanylidene-2-thiophen-2-yl-ethyl)pyridin-1-ium-3-yl]carbonyl-carbamate Openeye Name: ethyl N-amino-N-[1-[2-oxo-2-(2-thienyl)ethyl]pyridin-1-ium-3-carbonyl]carbamate CAS Name: N-amino-N-[oxo-[1-(2-oxo-2-thiophen-2-ylethyl)-3-pyridin-1-iumyl]methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-amino-N-[1-(2-oxo-2-thiophen-2-ylethyl)pyridin-1-ium-3-carbonyl]carbamate Traditional Name: N-amino-N-[1-[2-keto-2-(2-thienyl)ethyl]pyridin-1-ium-3-carbonyl]carbamic acid ethyl ester Formula: C15H16N3O4S+ MolecularWeight: 334.37024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(C(=O)C1=C[N+](=CC=C1)CC(=O)C2=CC=CS2)N

Isomeric SMILES

CCOC(=O)N(C(=O)C1=C[N+](=CC=C1)CC(=O)C2=CC=CS2)N

InChI

InChI=1S/C15H16N3O4S/c1-2-22-15(21)18(16)14(20)11-5-3-7-17(9-11)10-12(19)13-6-4-8-23-13/h3-9H,2,10,16H2,1H3/q+1