diethyl 3-methyl-5-(octanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-(octanoylamino)thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-(octanoylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-(1-oxooctylamino)thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-(octanoylamino)thiophene-2,4-dicarboxylate Traditional Name: 5-(caprylylamino)-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C19H29NO5S MolecularWeight: 383.50226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OCC

Isomeric SMILES

CCCCCCCC(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OCC

InChI

InChI=1S/C19H29NO5S/c1-5-8-9-10-11-12-14(21)20-17-15(18(22)24-6-2)13(4)16(26-17)19(23)25-7-3/h5-12H2,1-4H3,(H,20,21)