(2R,4R)-1,5-diisocyanato-3-oxidanyl-2,4-bis(phenylmethyl)pentane-1,5-dione

Systemtic Name: (2R,4R)-1,5-diisocyanato-3-oxidanyl-2,4-bis(phenylmethyl)pentane-1,5-dione Openeye Name: (2R,4R)-2,4-dibenzyl-3-hydroxy-pentanedioyl diisocyanate CAS Name: (2R,4R)-3-hydroxy-1,5-diisocyanato-2,4-bis(phenylmethyl)pentane-1,5-dione IUPAC Name: (2R,4R)-2,4-dibenzyl-3-hydroxypentanedioyl diisocyanate Traditional Name: (2R,4R)-2,4-dibenzyl-3-hydroxy-1,5-diisocyanato-pentane-1,5-dione Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(C(CC2=CC=CC=C2)C(=O)N=C=O)O)C(=O)N=C=O

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C([C@@H](CC2=CC=CC=C2)C(=O)N=C=O)O)C(=O)N=C=O

InChI

InChI=1S/C21H18N2O5/c24-13-22-20(27)17(11-15-7-3-1-4-8-15)19(26)18(21(28)23-14-25)12-16-9-5-2-6-10-16/h1-10,17-19,26H,11-12H2/t17-,18-/m1/s1