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

Systemtic Name: (phenylmethyl) N-[(2S,3R)-4-(butoxyamino)-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S,2R)-1-benzyl-3-(butoxyamino)-2-hydroxy-propyl]carbamate CAS Name: N-[(2S,3R)-4-(butoxyamino)-3-hydroxy-1-phenylbutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S,3R)-4-(butoxyamino)-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-benzyl-3-(butoxyamino)-2-hydroxy-propyl]carbamic acid benzyl ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCONCC(C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CCCCONC[C@H]([C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C22H30N2O4/c1-2-3-14-28-23-16-21(25)20(15-18-10-6-4-7-11-18)24-22(26)27-17-19-12-8-5-9-13-19/h4-13,20-21,23,25H,2-3,14-17H2,1H3,(H,24,26)/t20-,21+/m0/s1