(phenylmethyl) N-[(2R)-5-bromanyl-1-oxidanyl-pentan-2-yl]-N-(phenylmethoxycarbonylamino)carbamate

Systemtic Name: (phenylmethyl) N-[(2R)-5-bromanyl-1-oxidanyl-pentan-2-yl]-N-(phenylmethoxycarbonylamino)carbamate Openeye Name: benzyl N-(benzyloxycarbonylamino)-N-[(1R)-4-bromo-1-(hydroxymethyl)butyl]carbamate CAS Name: N-[(2R)-5-bromo-1-hydroxypentan-2-yl]-N-(phenylmethoxycarbonylamino)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2R)-5-bromo-1-hydroxypentan-2-yl]-N-(phenylmethoxycarbonylamino)carbamate Traditional Name: N-(benzyloxycarbonylamino)-N-[(1R)-4-bromo-1-methylol-butyl]carbamic acid benzyl ester Formula: C21H25BrN2O5 MolecularWeight: 465.3376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NN(C(CCCBr)CO)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NN([C@H](CCCBr)CO)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H25BrN2O5/c22-13-7-12-19(14-25)24(21(27)29-16-18-10-5-2-6-11-18)23-20(26)28-15-17-8-3-1-4-9-17/h1-6,8-11,19,25H,7,12-16H2,(H,23,26)/t19-/m1/s1