(phenylmethyl) 2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-(phenylmethoxycarbonylamino)ethanoate

Systemtic Name: (phenylmethyl) 2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-(phenylmethoxycarbonylamino)ethanoate Openeye Name: benzyl 2-(benzyloxycarbonylamino)-2-[4-(p-tolylsulfonyloxy)phenyl]acetate CAS Name: 2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-(phenylmethoxycarbonylamino)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-(phenylmethoxycarbonylamino)acetate Traditional Name: 2-(benzyloxycarbonylamino)-2-(4-tosyloxyphenyl)acetic acid benzyl ester Formula: C30H27NO7S MolecularWeight: 545.60288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(C(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(C(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C30H27NO7S/c1-22-12-18-27(19-13-22)39(34,35)38-26-16-14-25(15-17-26)28(29(32)36-20-23-8-4-2-5-9-23)31-30(33)37-21-24-10-6-3-7-11-24/h2-19,28H,20-21H2,1H3,(H,31,33)