(phenylmethyl) 2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]-2-phenyl-ethanoate

Systemtic Name: (phenylmethyl) 2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]-2-phenyl-ethanoate Openeye Name: benzyl 2-[benzyl(p-tolylsulfonyl)amino]-2-phenyl-acetate CAS Name: 2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]-2-phenylacetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[benzyl-(4-methylphenyl)sulfonylamino]-2-phenylacetate Traditional Name: 2-[benzyl(tosyl)amino]-2-phenyl-acetic acid benzyl ester Formula: C29H27NO4S MolecularWeight: 485.59398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C(C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C(C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H27NO4S/c1-23-17-19-27(20-18-23)35(32,33)30(21-24-11-5-2-6-12-24)28(26-15-9-4-10-16-26)29(31)34-22-25-13-7-3-8-14-25/h2-20,28H,21-22H2,1H3