ethyl 2-(2-morpholin-4-ium-4-ylethanoylamino)-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-morpholin-4-ium-4-ylethanoylamino)-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 5-isopropyl-2-[(2-morpholin-4-ium-4-ylacetyl)amino]thiophene-3-carboxylate CAS Name: 2-[[2-(4-morpholin-4-iumyl)-1-oxoethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-morpholin-4-ium-4-ylacetyl)amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 5-isopropyl-2-[(2-morpholin-4-ium-4-ylacetyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C16H25N2O4S+ MolecularWeight: 341.4457

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O4S/c1-4-22-16(20)12-9-13(11(2)3)23-15(12)17-14(19)10-18-5-7-21-8-6-18/h9,11H,4-8,10H2,1-3H3,(H,17,19)/p+1