propan-2-yl 4-ethyl-5-methyl-2-(octanoylamino)thiophene-3-carboxylate

Systemtic Name: propan-2-yl 4-ethyl-5-methyl-2-(octanoylamino)thiophene-3-carboxylate Openeye Name: isopropyl 4-ethyl-5-methyl-2-(octanoylamino)thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-(1-oxooctylamino)-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-ethyl-5-methyl-2-(octanoylamino)thiophene-3-carboxylate Traditional Name: 2-(caprylylamino)-4-ethyl-5-methyl-thiophene-3-carboxylic acid isopropyl ester Formula: C19H31NO3S MolecularWeight: 353.51934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31NO3S/c1-6-8-9-10-11-12-16(21)20-18-17(19(22)23-13(3)4)15(7-2)14(5)24-18/h13H,6-12H2,1-5H3,(H,20,21)