[4-(phenylmethyl)sulfonylphenyl]methyl 2-[(4-acetamidophenyl)carbonylamino]ethanoate

Systemtic Name: [4-(phenylmethyl)sulfonylphenyl]methyl 2-[(4-acetamidophenyl)carbonylamino]ethanoate Openeye Name: (4-benzylsulfonylphenyl)methyl 2-[(4-acetamidobenzoyl)amino]acetate CAS Name: 2-[[(4-acetamidophenyl)-oxomethyl]amino]acetic acid [4-(phenylmethyl)sulfonylphenyl]methyl ester IUPAC Name: (4-benzylsulfonylphenyl)methyl 2-[(4-acetamidobenzoyl)amino]acetate Traditional Name: 2-[(4-acetamidobenzoyl)amino]acetic acid (4-benzylsulfonylbenzyl) ester Formula: C25H24N2O6S MolecularWeight: 480.53286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC=C(C=C2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC=C(C=C2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C25H24N2O6S/c1-18(28)27-22-11-9-21(10-12-22)25(30)26-15-24(29)33-16-19-7-13-23(14-8-19)34(31,32)17-20-5-3-2-4-6-20/h2-14H,15-17H2,1H3,(H,26,30)(H,27,28)