2-(phenylmethyl)-3-phosphono-propanoic acid

Systemtic Name: 2-(phenylmethyl)-3-phosphono-propanoic acid Openeye Name: 2-benzyl-3-phosphono-propanoic acid CAS Name: 2-(phenylmethyl)-3-phosphonopropanoic acid IUPAC Name: 2-benzyl-3-phosphonopropanoic acid Traditional Name: 2-benzyl-3-phosphono-propionic acid Formula: C10H13O5P MolecularWeight: 244.180981

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13O5P/c11-10(12)9(7-16(13,14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)(H2,13,14,15)