2-[1-[oxidanyl(1-phenylprop-2-enyl)phosphoryl]ethyl]pentanedioic acid

Systemtic Name: 2-[1-[oxidanyl(1-phenylprop-2-enyl)phosphoryl]ethyl]pentanedioic acid Openeye Name: 2-[1-[hydroxy(1-phenylallyl)phosphoryl]ethyl]pentanedioic acid CAS Name: 2-[1-[hydroxy(1-phenylprop-2-enyl)phosphoryl]ethyl]pentanedioic acid IUPAC Name: 2-[1-[hydroxy(1-phenylprop-2-enyl)phosphoryl]ethyl]pentanedioic acid Traditional Name: 2-[1-[hydroxy(1-phenylallyl)phosphoryl]ethyl]glutaric acid Formula: C16H21O6P MolecularWeight: 340.308101

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21O6P/c1-3-14(12-7-5-4-6-8-12)23(21,22)11(2)13(16(19)20)9-10-15(17)18/h3-8,11,13-14H,1,9-10H2,2H3,(H,17,18)(H,19,20)(H,21,22)