[(2S)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 2-methoxy-5-methyl-benzoate

Systemtic Name: [(2S)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 2-methoxy-5-methyl-benzoate Openeye Name: [(1S)-2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl] 2-methoxy-5-methyl-benzoate CAS Name: 2-methoxy-5-methylbenzoic acid [(2S)-1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 2-methoxy-5-methylbenzoate Traditional Name: 2-methoxy-5-methyl-benzoic acid [(1S)-2-(2-furfurylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H19NO5 MolecularWeight: 317.33646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=O)OC(C)C(=O)NCC2=CC=CO2

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)O[C@@H](C)C(=O)NCC2=CC=CO2

InChI

InChI=1S/C17H19NO5/c1-11-6-7-15(21-3)14(9-11)17(20)23-12(2)16(19)18-10-13-5-4-8-22-13/h4-9,12H,10H2,1-3H3,(H,18,19)/t12-/m0/s1