[(2R,3R,4R,5R)-2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl] N-[(4-iodophenyl)methyl]carbamate

Systemtic Name: [(2R,3R,4R,5R)-2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl] N-[(4-iodophenyl)methyl]carbamate Openeye Name: [(2R,3R,4R,5R)-2-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl] N-[(4-iodophenyl)methyl]carbamate CAS Name: N-[(4-iodophenyl)methyl]carbamic acid [(2R,3R,4R,5R)-2-(2,4-dioxo-1-pyrimidinyl)-4-hydroxy-5-(hydroxymethyl)-3-oxolanyl] ester IUPAC Name: [(2R,3R,4R,5R)-2-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] N-[(4-iodophenyl)methyl]carbamate Traditional Name: N-(4-iodobenzyl)carbamic acid [(2R,3R,4R,5R)-2-(2,4-diketopyrimidin-1-yl)-4-hydroxy-5-methylol-tetrahydrofuran-3-yl] ester Formula: C17H18IN3O7 MolecularWeight: 503.24519

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)OC2C(C(OC2N3C=CC(=O)NC3=O)CO)O)I

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)O[C@@H]2[C@@H]([C@H](O[C@H]2N3C=CC(=O)NC3=O)CO)O)I

InChI

InChI=1S/C17H18IN3O7/c18-10-3-1-9(2-4-10)7-19-17(26)28-14-13(24)11(8-22)27-15(14)21-6-5-12(23)20-16(21)25/h1-6,11,13-15,22,24H,7-8H2,(H,19,26)(H,20,23,25)/t11-,13-,14-,15-/m1/s1