ethanedioic acid; ethyl 5-ethyl-2-(3-piperidin-1-ylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: ethanedioic acid; ethyl 5-ethyl-2-(3-piperidin-1-ylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[3-(1-piperidyl)propanoylamino]thiophene-3-carboxylate; oxalic acid CAS Name: 5-ethyl-2-[[1-oxo-3-(1-piperidinyl)propyl]amino]-3-thiophenecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 5-ethyl-2-(3-piperidin-1-ylpropanoylamino)thiophene-3-carboxylate; oxalic acid Traditional Name: 5-ethyl-2-(3-piperidinopropanoylamino)thiophene-3-carboxylic acid ethyl ester; oxalic acid Formula: C19H28N2O7S MolecularWeight: 428.49982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CCN2CCCCC2)C(=O)OCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CCN2CCCCC2)C(=O)OCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H26N2O3S.C2H2O4/c1-3-13-12-14(17(21)22-4-2)16(23-13)18-15(20)8-11-19-9-6-5-7-10-19;3-1(4)2(5)6/h12H,3-11H2,1-2H3,(H,18,20);(H,3,4)(H,5,6)