ethanedioic acid; O4-ethyl O2-(2-methoxyethyl) 3-methyl-5-[2-(phenethylamino)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: ethanedioic acid; O4-ethyl O2-(2-methoxyethyl) 3-methyl-5-[2-(phenethylamino)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-(2-methoxyethyl) 3-methyl-5-[[2-(phenethylamino)acetyl]amino]thiophene-2,4-dicarboxylate; oxalic acid CAS Name: 3-methyl-5-[[1-oxo-2-(phenethylamino)ethyl]amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-(2-methoxyethyl) ester; oxalic acid IUPAC Name: 4-O-ethyl 2-O-(2-methoxyethyl) 3-methyl-5-[[2-(phenethylamino)acetyl]amino]thiophene-2,4-dicarboxylate; oxalic acid Traditional Name: 3-methyl-5-[[2-(phenethylamino)acetyl]amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-(2-methoxyethyl) ester; oxalic acid Formula: C24H30N2O10S MolecularWeight: 538.5674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCCOC)NC(=O)CNCCC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCCOC)NC(=O)CNCCC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H28N2O6S.C2H2O4/c1-4-29-21(26)18-15(2)19(22(27)30-13-12-28-3)31-20(18)24-17(25)14-23-11-10-16-8-6-5-7-9-16;3-1(4)2(5)6/h5-9,23H,4,10-14H2,1-3H3,(H,24,25);(H,3,4)(H,5,6)