(2R,3S)-2-cyano-4,4,5-trimethoxy-5-oxidanylidene-3-phenyl-pentanoic acid

Systemtic Name: (2R,3S)-2-cyano-4,4,5-trimethoxy-5-oxidanylidene-3-phenyl-pentanoic acid Openeye Name: (2R,3S)-2-cyano-4,4,5-trimethoxy-5-oxo-3-phenyl-pentanoic acid CAS Name: (2R,3S)-2-cyano-4,4,5-trimethoxy-5-oxo-3-phenylpentanoic acid IUPAC Name: (2R,3S)-2-cyano-4,4,5-trimethoxy-5-oxo-3-phenylpentanoic acid Traditional Name: (2R,3S)-2-cyano-5-keto-4,4,5-trimethoxy-3-phenyl-valeric acid Formula: C15H17NO6 MolecularWeight: 307.29858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1=CC=CC=C1)C(C#N)C(=O)O)(OC)OC

Isomeric SMILES

COC(=O)C([C@H](C1=CC=CC=C1)[C@H](C#N)C(=O)O)(OC)OC

InChI

InChI=1S/C15H17NO6/c1-20-14(19)15(21-2,22-3)12(11(9-16)13(17)18)10-7-5-4-6-8-10/h4-8,11-12H,1-3H3,(H,17,18)/t11-,12+/m0/s1