(phenylmethyl) (2S)-6-oxidanylidene-2-[(5-oxidanylidene-2-prop-2-ynyl-oxolan-2-yl)carbonylamino]hexanoate

Systemtic Name: (phenylmethyl) (2S)-6-oxidanylidene-2-[(5-oxidanylidene-2-prop-2-ynyl-oxolan-2-yl)carbonylamino]hexanoate Openeye Name: benzyl (2S)-6-oxo-2-[(5-oxo-2-prop-2-ynyl-tetrahydrofuran-2-carbonyl)amino]hexanoate CAS Name: (2S)-6-oxo-2-[[oxo-(5-oxo-2-prop-2-ynyl-2-oxolanyl)methyl]amino]hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-6-oxo-2-[(5-oxo-2-prop-2-ynyloxolane-2-carbonyl)amino]hexanoate Traditional Name: (2S)-6-keto-2-[(5-keto-2-propargyl-tetrahydrofuran-2-carbonyl)amino]hexanoic acid benzyl ester Formula: C21H23NO6 MolecularWeight: 385.41042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCC1(CCC(=O)O1)C(=O)NC(CCCC=O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C#CCC1(CCC(=O)O1)C(=O)N[C@@H](CCCC=O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H23NO6/c1-2-12-21(13-11-18(24)28-21)20(26)22-17(10-6-7-14-23)19(25)27-15-16-8-4-3-5-9-16/h1,3-5,8-9,14,17H,6-7,10-13,15H2,(H,22,26)/t17-,21?/m0/s1