(phenylmethyl) 2-[(2,2-dimethyl-4-oxidanyl-4-phenyl-cyclopentyl)-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[(2,2-dimethyl-4-oxidanyl-4-phenyl-cyclopentyl)-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: benzyl 2-[(4-hydroxy-2,2-dimethyl-4-phenyl-cyclopentyl)-(p-tolylsulfonyl)amino]acetate CAS Name: 2-[(4-hydroxy-2,2-dimethyl-4-phenylcyclopentyl)-(4-methylphenyl)sulfonylamino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4-hydroxy-2,2-dimethyl-4-phenylcyclopentyl)-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[(4-hydroxy-2,2-dimethyl-4-phenyl-cyclopentyl)-tosyl-amino]acetic acid benzyl ester Formula: C29H33NO5S MolecularWeight: 507.64102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)OCC2=CC=CC=C2)C3CC(CC3(C)C)(C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)OCC2=CC=CC=C2)C3CC(CC3(C)C)(C4=CC=CC=C4)O

InChI

InChI=1S/C29H33NO5S/c1-22-14-16-25(17-15-22)36(33,34)30(19-27(31)35-20-23-10-6-4-7-11-23)26-18-29(32,21-28(26,2)3)24-12-8-5-9-13-24/h4-17,26,32H,18-21H2,1-3H3