[(2R)-1-[2-(3,4-dimethoxyphenyl)ethylamino]-1-oxidanylidene-propan-2-yl] thiophene-2-carboxylate

Systemtic Name: [(2R)-1-[2-(3,4-dimethoxyphenyl)ethylamino]-1-oxidanylidene-propan-2-yl] thiophene-2-carboxylate Openeye Name: [(1R)-2-[2-(3,4-dimethoxyphenyl)ethylamino]-1-methyl-2-oxo-ethyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [(2R)-1-[2-(3,4-dimethoxyphenyl)ethylamino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[2-(3,4-dimethoxyphenyl)ethylamino]-1-oxopropan-2-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [(1R)-2-(homoveratrylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H21NO5S MolecularWeight: 363.42804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC(=C(C=C1)OC)OC)OC(=O)C2=CC=CS2

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC(=C(C=C1)OC)OC)OC(=O)C2=CC=CS2

InChI

InChI=1S/C18H21NO5S/c1-12(24-18(21)16-5-4-10-25-16)17(20)19-9-8-13-6-7-14(22-2)15(11-13)23-3/h4-7,10-12H,8-9H2,1-3H3,(H,19,20)/t12-/m1/s1