3-[(2-methylpropan-2-yl)oxycarbonyl]-2-(2-methylpropyl)-5-methylsulfonyloxy-2-(phenylmethyl)pentanoic acid

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonyl]-2-(2-methylpropyl)-5-methylsulfonyloxy-2-(phenylmethyl)pentanoic acid Openeye Name: 2-benzyl-3-tert-butoxycarbonyl-2-isobutyl-5-methylsulfonyloxy-pentanoic acid CAS Name: 3-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-(2-methylpropyl)-5-methylsulfonyloxy-2-(phenylmethyl)pentanoic acid IUPAC Name: 2-benzyl-3-[(2-methylpropan-2-yl)oxycarbonyl]-2-(2-methylpropyl)-5-methylsulfonyloxypentanoic acid Traditional Name: 2-benzyl-3-tert-butoxycarbonyl-2-isobutyl-5-methylsulfonyloxy-valeric acid Formula: C22H34O7S MolecularWeight: 442.56616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC1=CC=CC=C1)(C(CCOS(=O)(=O)C)C(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC(C)CC(CC1=CC=CC=C1)(C(CCOS(=O)(=O)C)C(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C22H34O7S/c1-16(2)14-22(20(24)25,15-17-10-8-7-9-11-17)18(12-13-28-30(6,26)27)19(23)29-21(3,4)5/h7-11,16,18H,12-15H2,1-6H3,(H,24,25)