O4-ethyl O2-methyl 3-methyl-5-(2-morpholin-4-ium-4-ylethanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-methyl 3-methyl-5-(2-morpholin-4-ium-4-ylethanoylamino)thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-methyl 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 O4-ethyl ester O2-methyl ester IUPAC Name: 4-O-ethyl 2-O-methyl 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 O4-ethyl ester O2-methyl ester Formula: C16H23N2O6S+ MolecularWeight: 371.42862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O6S/c1-4-24-15(20)12-10(2)13(16(21)22-3)25-14(12)17-11(19)9-18-5-7-23-8-6-18/h4-9H2,1-3H3,(H,17,19)/p+1