iodanylmethyl 5-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]oxymethyl]furan-2-carboxylate

Systemtic Name: iodanylmethyl 5-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]oxymethyl]furan-2-carboxylate Openeye Name: iodomethyl 5-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentoxy]methyl]-2-furancarboxylic acid iodomethyl ester IUPAC Name: iodomethyl 5-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]oxymethyl]furan-2-carboxylic acid iodomethyl ester Formula: C21H24INO7 MolecularWeight: 529.32223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC1=CC=C(O1)C(=O)OCI)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)OCC1=CC=C(O1)C(=O)OCI)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24INO7/c1-3-14(2)18(23-21(26)28-11-15-7-5-4-6-8-15)20(25)27-12-16-9-10-17(30-16)19(24)29-13-22/h4-10,14,18H,3,11-13H2,1-2H3,(H,23,26)