ethanedioic acid; methyl 4,5-dimethyl-2-[2-(2-methylpiperidin-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethanedioic acid; methyl 4,5-dimethyl-2-[2-(2-methylpiperidin-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-(2-methyl-1-piperidyl)acetyl]amino]thiophene-3-carboxylate; oxalic acid CAS Name: 4,5-dimethyl-2-[[2-(2-methyl-1-piperidinyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester; oxalic acid IUPAC Name: methyl 4,5-dimethyl-2-[[2-(2-methylpiperidin-1-yl)acetyl]amino]thiophene-3-carboxylate; oxalic acid Traditional Name: 4,5-dimethyl-2-[[2-(2-methylpiperidino)acetyl]amino]thiophene-3-carboxylic acid methyl ester; oxalic acid Formula: C18H26N2O7S MolecularWeight: 414.47324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC(=O)NC2=C(C(=C(S2)C)C)C(=O)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCCN1CC(=O)NC2=C(C(=C(S2)C)C)C(=O)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H24N2O3S.C2H2O4/c1-10-7-5-6-8-18(10)9-13(19)17-15-14(16(20)21-4)11(2)12(3)22-15;3-1(4)2(5)6/h10H,5-9H2,1-4H3,(H,17,19);(H,3,4)(H,5,6)