(2R)-2-[2-(4-methylphenyl)sulfonylethyl]-2-(phenylmethoxycarbonylamino)pentanedioic acid

Systemtic Name: (2R)-2-[2-(4-methylphenyl)sulfonylethyl]-2-(phenylmethoxycarbonylamino)pentanedioic acid Openeye Name: (2R)-2-(benzyloxycarbonylamino)-2-[2-(p-tolylsulfonyl)ethyl]pentanedioic acid CAS Name: (2R)-2-[2-(4-methylphenyl)sulfonylethyl]-2-(phenylmethoxycarbonylamino)pentanedioic acid IUPAC Name: (2R)-2-[2-(4-methylphenyl)sulfonylethyl]-2-(phenylmethoxycarbonylamino)pentanedioic acid Traditional Name: (2R)-2-(benzyloxycarbonylamino)-2-(2-tosylethyl)glutaric acid Formula: C22H25NO8S MolecularWeight: 463.5008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(CCC(=O)O)(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC[C@](CCC(=O)O)(C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H25NO8S/c1-16-7-9-18(10-8-16)32(29,30)14-13-22(20(26)27,12-11-19(24)25)23-21(28)31-15-17-5-3-2-4-6-17/h2-10H,11-15H2,1H3,(H,23,28)(H,24,25)(H,26,27)/t22-/m1/s1