2-methoxy-2-(phenylmethyl)-3-phosphono-butanedioic acid

Systemtic Name: 2-methoxy-2-(phenylmethyl)-3-phosphono-butanedioic acid Openeye Name: 2-benzyl-2-methoxy-3-phosphono-butanedioic acid CAS Name: 2-methoxy-2-(phenylmethyl)-3-phosphonobutanedioic acid IUPAC Name: 2-benzyl-2-methoxy-3-phosphonobutanedioic acid Traditional Name: 2-benzyl-2-methoxy-3-phosphono-succinic acid Formula: C12H15O8P MolecularWeight: 318.216461

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15O8P/c1-20-12(11(15)16,7-8-5-3-2-4-6-8)9(10(13)14)21(17,18)19/h2-6,9H,7H2,1H3,(H,13,14)(H,15,16)(H2,17,18,19)