4,4-dimethyl-3-[oxidanyl-(phenylmethyl)phosphoryl]-2-(2-phenylpropyl)pentanoic acid

Systemtic Name: 4,4-dimethyl-3-[oxidanyl-(phenylmethyl)phosphoryl]-2-(2-phenylpropyl)pentanoic acid Openeye Name: 3-[benzyl(hydroxy)phosphoryl]-4,4-dimethyl-2-(2-phenylpropyl)pentanoic acid CAS Name: 3-[hydroxy-(phenylmethyl)phosphoryl]-4,4-dimethyl-2-(2-phenylpropyl)pentanoic acid IUPAC Name: 3-[benzyl(hydroxy)phosphoryl]-4,4-dimethyl-2-(2-phenylpropyl)pentanoic acid Traditional Name: 3-[benzyl(hydroxy)phosphoryl]-4,4-dimethyl-2-(2-phenylpropyl)valeric acid Formula: C23H31O4P MolecularWeight: 402.463601

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C(C(C)(C)C)P(=O)(CC1=CC=CC=C1)O)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC(CC(C(C(C)(C)C)P(=O)(CC1=CC=CC=C1)O)C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C23H31O4P/c1-17(19-13-9-6-10-14-19)15-20(22(24)25)21(23(2,3)4)28(26,27)16-18-11-7-5-8-12-18/h5-14,17,20-21H,15-16H2,1-4H3,(H,24,25)(H,26,27)