(phenylmethyl) N-[(2S,3R)-3-oxidanyl-1-phenyl-4-[(phenylmethyl)amino]butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S,3R)-3-oxidanyl-1-phenyl-4-[(phenylmethyl)amino]butan-2-yl]carbamate Openeye Name: benzyl N-[(1S,2R)-1-benzyl-3-(benzylamino)-2-hydroxy-propyl]carbamate CAS Name: N-[(2S,3R)-3-hydroxy-1-phenyl-4-[(phenylmethyl)amino]butan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S,3R)-4-(benzylamino)-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-benzyl-3-(benzylamino)-2-hydroxy-propyl]carbamic acid benzyl ester Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(CNCC2=CC=CC=C2)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H]([C@@H](CNCC2=CC=CC=C2)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3/c28-24(18-26-17-21-12-6-2-7-13-21)23(16-20-10-4-1-5-11-20)27-25(29)30-19-22-14-8-3-9-15-22/h1-15,23-24,26,28H,16-19H2,(H,27,29)/t23-,24+/m0/s1