1-[(3R,4R,5R)-4-[(1S)-1,2-bis(oxidanyl)ethyl]-5-methyl-2-oxidanylidene-oxolan-3-yl]-1-[(4-iodophenyl)methyl]-3-phenyl-urea

Systemtic Name: 1-[(3R,4R,5R)-4-[(1S)-1,2-bis(oxidanyl)ethyl]-5-methyl-2-oxidanylidene-oxolan-3-yl]-1-[(4-iodophenyl)methyl]-3-phenyl-urea Openeye Name: 1-[(3R,4R,5R)-4-[(1S)-1,2-dihydroxyethyl]-5-methyl-2-oxo-tetrahydrofuran-3-yl]-1-[(4-iodophenyl)methyl]-3-phenyl-urea CAS Name: 1-[(3R,4R,5R)-4-[(1S)-1,2-dihydroxyethyl]-5-methyl-2-oxo-3-oxolanyl]-1-[(4-iodophenyl)methyl]-3-phenylurea IUPAC Name: 1-[(3R,4R,5R)-4-[(1S)-1,2-dihydroxyethyl]-5-methyl-2-oxooxolan-3-yl]-1-[(4-iodophenyl)methyl]-3-phenylurea Traditional Name: 1-[(3R,4R,5R)-4-[(1S)-1,2-dihydroxyethyl]-2-keto-5-methyl-tetrahydrofuran-3-yl]-1-(4-iodobenzyl)-3-phenyl-urea Formula: C21H23IN2O5 MolecularWeight: 510.32219

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(=O)O1)N(CC2=CC=C(C=C2)I)C(=O)NC3=CC=CC=C3)C(CO)O

Isomeric SMILES

C[C@@H]1[C@H]([C@H](C(=O)O1)N(CC2=CC=C(C=C2)I)C(=O)NC3=CC=CC=C3)[C@@H](CO)O

InChI

InChI=1S/C21H23IN2O5/c1-13-18(17(26)12-25)19(20(27)29-13)24(11-14-7-9-15(22)10-8-14)21(28)23-16-5-3-2-4-6-16/h2-10,13,17-19,25-26H,11-12H2,1H3,(H,23,28)/t13-,17-,18+,19-/m1/s1