2-cyclohexyl-3-[oxidanyl-(phenylmethyl)phosphoryl]-3-phenyl-propanoic acid

Systemtic Name: 2-cyclohexyl-3-[oxidanyl-(phenylmethyl)phosphoryl]-3-phenyl-propanoic acid Openeye Name: 3-[benzyl(hydroxy)phosphoryl]-2-cyclohexyl-3-phenyl-propanoic acid CAS Name: 2-cyclohexyl-3-[hydroxy-(phenylmethyl)phosphoryl]-3-phenylpropanoic acid IUPAC Name: 3-[benzyl(hydroxy)phosphoryl]-2-cyclohexyl-3-phenylpropanoic acid Traditional Name: 3-[benzyl(hydroxy)phosphoryl]-2-cyclohexyl-3-phenyl-propionic acid Formula: C22H27O4P MolecularWeight: 386.421141

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(C2=CC=CC=C2)P(=O)(CC3=CC=CC=C3)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)C(C(C2=CC=CC=C2)P(=O)(CC3=CC=CC=C3)O)C(=O)O

InChI

InChI=1S/C22H27O4P/c23-22(24)20(18-12-6-2-7-13-18)21(19-14-8-3-9-15-19)27(25,26)16-17-10-4-1-5-11-17/h1,3-5,8-11,14-15,18,20-21H,2,6-7,12-13,16H2,(H,23,24)(H,25,26)