diethyl 3-methyl-5-(2-morpholin-4-ium-4-ylethanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-(2-morpholin-4-ium-4-ylethanoylamino)thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[(2-morpholin-4-ium-4-ylacetyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(4-morpholin-4-iumyl)-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(2-morpholin-4-ium-4-ylacetyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(2-morpholin-4-ium-4-ylacetyl)amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C17H25N2O6S+ MolecularWeight: 385.4552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C[NH+]2CCOCC2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C[NH+]2CCOCC2

InChI

InChI=1S/C17H24N2O6S/c1-4-24-16(21)13-11(3)14(17(22)25-5-2)26-15(13)18-12(20)10-19-6-8-23-9-7-19/h4-10H2,1-3H3,(H,18,20)/p+1