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

Systemtic Name: dimethyl 3-methyl-5-(octanoylamino)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-(octanoylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-(1-oxooctylamino)thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-(octanoylamino)thiophene-2,4-dicarboxylate Traditional Name: 5-(caprylylamino)-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H25NO5S MolecularWeight: 355.4491

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO5S/c1-5-6-7-8-9-10-12(19)18-15-13(16(20)22-3)11(2)14(24-15)17(21)23-4/h5-10H2,1-4H3,(H,18,19)