chloromethyl 5-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]oxymethyl]furan-2-carboxylate

Systemtic Name: chloromethyl 5-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]oxymethyl]furan-2-carboxylate Openeye Name: chloromethyl 5-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butoxy]methyl]-2-furancarboxylic acid chloromethyl ester IUPAC Name: chloromethyl 5-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]oxymethyl]furan-2-carboxylic acid chloromethyl ester Formula: C20H22ClNO7 MolecularWeight: 423.84418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=C(O1)C(=O)OCCl)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC=C(O1)C(=O)OCCl)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22ClNO7/c1-13(2)17(22-20(25)27-10-14-6-4-3-5-7-14)19(24)26-11-15-8-9-16(29-15)18(23)28-12-21/h3-9,13,17H,10-12H2,1-2H3,(H,22,25)