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

Systemtic Name: methyl 4,5-dimethyl-2-(octanoylamino)thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-(octanoylamino)thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-(1-oxooctylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-(octanoylamino)thiophene-3-carboxylate Traditional Name: 2-(caprylylamino)-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C16H25NO3S MolecularWeight: 311.4396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO3S/c1-5-6-7-8-9-10-13(18)17-15-14(16(19)20-4)11(2)12(3)21-15/h5-10H2,1-4H3,(H,17,18)