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2-[1-[oxidanyl(3-phenylpropyl)phosphoryl]heptyl]pentanedioic acid

2-[1-[oxidanyl(3-phenylpropyl)phosphoryl]heptyl]pentanedioic acid

Systemtic Name:2-[1-[oxidanyl(3-phenylpropyl)phosphoryl]heptyl]pentanedioic acid
Openeye Name:2-[1-[hydroxy(3-phenylpropyl)phosphoryl]heptyl]pentanedioic acid
CAS Name:2-[1-[hydroxy(3-phenylpropyl)phosphoryl]heptyl]pentanedioic acid
IUPAC Name:2-[1-[hydroxy(3-phenylpropyl)phosphoryl]heptyl]pentanedioic acid
Traditional Name:2-[1-[hydroxy(3-phenylpropyl)phosphoryl]heptyl]glutaric acid
Formula: C21H33O6P
MolecularWeight: 412.456881
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(CCC(=O)O)C(=O)O)P(=O)(CCCC1=CC=CC=C1)O


Isomeric SMILES

CCCCCCC(C(CCC(=O)O)C(=O)O)P(=O)(CCCC1=CC=CC=C1)O


InChI

InChI=1S/C21H33O6P/c1-2-3-4-8-13-19(18(21(24)25)14-15-20(22)23)28(26,27)16-9-12-17-10-6-5-7-11-17/h5-7,10-11,18-19H,2-4,8-9,12-16H2,1H3,(H,22,23)(H,24,25)(H,26,27)


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