methyl 3-[[2-(2-morpholin-4-ium-4-ylethylamino)-2-oxidanylidene-ethanoyl]amino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[2-(2-morpholin-4-ium-4-ylethylamino)-2-oxidanylidene-ethanoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(2-morpholin-4-ium-4-ylethylamino)-2-oxo-acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-[2-(4-morpholin-4-iumyl)ethylamino]-1,2-dioxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(2-morpholin-4-ium-4-ylethylamino)-2-oxoacetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-keto-2-(2-morpholin-4-ium-4-ylethylamino)acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C14H20N3O5S+ MolecularWeight: 342.3907

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C(=O)NCC[NH+]2CCOCC2

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C(=O)NCC[NH+]2CCOCC2

InChI

InChI=1S/C14H19N3O5S/c1-21-14(20)11-10(2-9-23-11)16-13(19)12(18)15-3-4-17-5-7-22-8-6-17/h2,9H,3-8H2,1H3,(H,15,18)(H,16,19)/p+1