ethanedioic acid; ethyl 2-[2-(2-methoxyethylamino)ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethanedioic acid; ethyl 2-[2-(2-methoxyethylamino)ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]-4-phenyl-thiophene-3-carboxylate; oxalic acid CAS Name: 2-[[2-(2-methoxyethylamino)-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]-4-phenylthiophene-3-carboxylate; oxalic acid Traditional Name: 2-[[2-(2-methoxyethylamino)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester; oxalic acid Formula: C20H24N2O8S MolecularWeight: 452.47816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CNCCOC.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CNCCOC.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H22N2O4S.C2H2O4/c1-3-24-18(22)16-14(13-7-5-4-6-8-13)12-25-17(16)20-15(21)11-19-9-10-23-2;3-1(4)2(5)6/h4-8,12,19H,3,9-11H2,1-2H3,(H,20,21);(H,3,4)(H,5,6)