dimethyl (2S)-2-[(4-methylphenyl)sulfonyl-phenylmethoxycarbonyl-amino]pentanedioate

Systemtic Name: dimethyl (2S)-2-[(4-methylphenyl)sulfonyl-phenylmethoxycarbonyl-amino]pentanedioate Openeye Name: dimethyl (2S)-2-[benzyloxycarbonyl(p-tolylsulfonyl)amino]pentanedioate CAS Name: (2S)-2-[(4-methylphenyl)sulfonyl-phenylmethoxycarbonylamino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl (2S)-2-[(4-methylphenyl)sulfonyl-phenylmethoxycarbonylamino]pentanedioate Traditional Name: (2S)-2-[carbobenzoxy(tosyl)amino]glutaric acid dimethyl ester Formula: C22H25NO8S MolecularWeight: 463.5008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO8S/c1-16-9-11-18(12-10-16)32(27,28)23(19(21(25)30-3)13-14-20(24)29-2)22(26)31-15-17-7-5-4-6-8-17/h4-12,19H,13-15H2,1-3H3/t19-/m0/s1