(2,2-dimethyl-3-oxidanyl-propyl) 2-[2-[(4-methylphenyl)sulfonylamino]-2-phenyl-ethyl]-5-oxidanylidene-5-phenyl-pentanoate

Systemtic Name: (2,2-dimethyl-3-oxidanyl-propyl) 2-[2-[(4-methylphenyl)sulfonylamino]-2-phenyl-ethyl]-5-oxidanylidene-5-phenyl-pentanoate Openeye Name: (3-hydroxy-2,2-dimethyl-propyl) 5-oxo-5-phenyl-2-[2-phenyl-2-(p-tolylsulfonylamino)ethyl]pentanoate CAS Name: 2-[2-[(4-methylphenyl)sulfonylamino]-2-phenylethyl]-5-oxo-5-phenylpentanoic acid (3-hydroxy-2,2-dimethylpropyl) ester IUPAC Name: (3-hydroxy-2,2-dimethylpropyl) 2-[2-[(4-methylphenyl)sulfonylamino]-2-phenylethyl]-5-oxo-5-phenylpentanoate Traditional Name: 5-keto-5-phenyl-2-[2-phenyl-2-(tosylamino)ethyl]valeric acid (3-hydroxy-2,2-dimethyl-propyl) ester Formula: C31H37NO6S MolecularWeight: 551.69358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(CCC(=O)C2=CC=CC=C2)C(=O)OCC(C)(C)CO)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(CCC(=O)C2=CC=CC=C2)C(=O)OCC(C)(C)CO)C3=CC=CC=C3

InChI

InChI=1S/C31H37NO6S/c1-23-14-17-27(18-15-23)39(36,37)32-28(24-10-6-4-7-11-24)20-26(30(35)38-22-31(2,3)21-33)16-19-29(34)25-12-8-5-9-13-25/h4-15,17-18,26,28,32-33H,16,19-22H2,1-3H3