(phenylmethyl) (2S,3R)-2-(4-methylphenyl)sulfonyloxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-pentanoate

Systemtic Name: (phenylmethyl) (2S,3R)-2-(4-methylphenyl)sulfonyloxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-pentanoate Openeye Name: benzyl (2S,3R)-5-(tert-butoxycarbonylamino)-3-hydroxy-2-(p-tolylsulfonyloxy)pentanoate CAS Name: (2S,3R)-3-hydroxy-2-(4-methylphenyl)sulfonyloxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3R)-3-hydroxy-2-(4-methylphenyl)sulfonyloxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (2S,3R)-5-(tert-butoxycarbonylamino)-3-hydroxy-2-tosyloxy-valeric acid benzyl ester Formula: C24H31NO8S MolecularWeight: 493.56984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C(CCNC(=O)OC(C)(C)C)O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]([C@@H](CCNC(=O)OC(C)(C)C)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H31NO8S/c1-17-10-12-19(13-11-17)34(29,30)33-21(22(27)31-16-18-8-6-5-7-9-18)20(26)14-15-25-23(28)32-24(2,3)4/h5-13,20-21,26H,14-16H2,1-4H3,(H,25,28)/t20-,21+/m1/s1