2-[1-[(4-methylphenyl)methyl-oxidanyl-phosphoryl]but-3-enyl]pentanedioic acid

Systemtic Name: 2-[1-[(4-methylphenyl)methyl-oxidanyl-phosphoryl]but-3-enyl]pentanedioic acid Openeye Name: 2-[1-[hydroxy(p-tolylmethyl)phosphoryl]but-3-enyl]pentanedioic acid CAS Name: 2-[1-[hydroxy-[(4-methylphenyl)methyl]phosphoryl]but-3-enyl]pentanedioic acid IUPAC Name: 2-[1-[hydroxy-[(4-methylphenyl)methyl]phosphoryl]but-3-enyl]pentanedioic acid Traditional Name: 2-[1-[hydroxy-(4-methylbenzyl)phosphoryl]but-3-enyl]glutaric acid Formula: C17H23O6P MolecularWeight: 354.334681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CP(=O)(C(CC=C)C(CCC(=O)O)C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CP(=O)(C(CC=C)C(CCC(=O)O)C(=O)O)O

InChI

InChI=1S/C17H23O6P/c1-3-4-15(14(17(20)21)9-10-16(18)19)24(22,23)11-13-7-5-12(2)6-8-13/h3,5-8,14-15H,1,4,9-11H2,2H3,(H,18,19)(H,20,21)(H,22,23)