methyl 3-[2-(2,4,6-trimethylphenyl)ethanoylamino]thiolane-3-carboxylate

Systemtic Name: methyl 3-[2-(2,4,6-trimethylphenyl)ethanoylamino]thiolane-3-carboxylate Openeye Name: methyl 3-[[2-(2,4,6-trimethylphenyl)acetyl]amino]tetrahydrothiophene-3-carboxylate CAS Name: 3-[[1-oxo-2-(2,4,6-trimethylphenyl)ethyl]amino]-3-thiolanecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(2,4,6-trimethylphenyl)acetyl]amino]thiolane-3-carboxylate Traditional Name: 3-[(2-mesitylacetyl)amino]tetrahydrothiophene-3-carboxylic acid methyl ester Formula: C17H23NO3S MolecularWeight: 321.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CC(=O)NC2(CCSC2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CC(=O)NC2(CCSC2)C(=O)OC)C

InChI

InChI=1S/C17H23NO3S/c1-11-7-12(2)14(13(3)8-11)9-15(19)18-17(16(20)21-4)5-6-22-10-17/h7-8H,5-6,9-10H2,1-4H3,(H,18,19)