ethyl 2-(2-morpholin-4-ium-4-ylethanoylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-(2-morpholin-4-ium-4-ylethanoylamino)-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[(2-morpholin-4-ium-4-ylacetyl)amino]thiazole-4-carboxylate CAS Name: 2-[[2-(4-morpholin-4-iumyl)-1-oxoethyl]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-morpholin-4-ium-4-ylacetyl)amino]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(2-morpholin-4-ium-4-ylacetyl)amino]thiazole-4-carboxylic acid ethyl ester Formula: C12H18N3O4S+ MolecularWeight: 300.35402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)NC(=O)C[NH+]2CCOCC2

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)NC(=O)C[NH+]2CCOCC2

InChI

InChI=1S/C12H17N3O4S/c1-2-19-11(17)9-8-20-12(13-9)14-10(16)7-15-3-5-18-6-4-15/h8H,2-7H2,1H3,(H,13,14,16)/p+1