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

Systemtic Name: dimethyl 3-methyl-5-(2-morpholin-4-ium-4-ylethanoylamino)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 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 dimethyl ester IUPAC Name: dimethyl 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 dimethyl ester Formula: C15H21N2O6S+ MolecularWeight: 357.40204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C[NH+]2CCOCC2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C[NH+]2CCOCC2)C(=O)OC

InChI

InChI=1S/C15H20N2O6S/c1-9-11(14(19)21-2)13(24-12(9)15(20)22-3)16-10(18)8-17-4-6-23-7-5-17/h4-8H2,1-3H3,(H,16,18)/p+1