2-[1-[oxidanyl-(phenylmethyl)phosphoryl]butyl]hexanedioic acid

Systemtic Name: 2-[1-[oxidanyl-(phenylmethyl)phosphoryl]butyl]hexanedioic acid Openeye Name: 2-[1-[benzyl(hydroxy)phosphoryl]butyl]hexanedioic acid CAS Name: 2-[1-[hydroxy-(phenylmethyl)phosphoryl]butyl]hexanedioic acid IUPAC Name: 2-[1-[benzyl(hydroxy)phosphoryl]butyl]hexanedioic acid Traditional Name: 2-[1-[benzyl(hydroxy)phosphoryl]butyl]adipic acid Formula: C17H25O6P MolecularWeight: 356.350561

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25O6P/c1-2-7-15(14(17(20)21)10-6-11-16(18)19)24(22,23)12-13-8-4-3-5-9-13/h3-5,8-9,14-15H,2,6-7,10-12H2,1H3,(H,18,19)(H,20,21)(H,22,23)