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

Systemtic Name: (phenylmethyl) 2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-[(phenylmethyl)amino]ethanoate Openeye Name: benzyl 2-(benzylamino)-2-[4-(p-tolylsulfonyloxy)phenyl]acetate CAS Name: 2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-[(phenylmethyl)amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(benzylamino)-2-[4-(4-methylphenyl)sulfonyloxyphenyl]acetate Traditional Name: 2-(benzylamino)-2-(4-tosyloxyphenyl)acetic acid benzyl ester Formula: C29H27NO5S MolecularWeight: 501.59338

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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)NCC4=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)NCC4=CC=CC=C4

InChI

InChI=1S/C29H27NO5S/c1-22-12-18-27(19-13-22)36(32,33)35-26-16-14-25(15-17-26)28(30-20-23-8-4-2-5-9-23)29(31)34-21-24-10-6-3-7-11-24/h2-19,28,30H,20-21H2,1H3