methyl (2E,4S)-4-acetyloxy-2-[methoxy(oxidanyl)methylidene]-3-oxidanylidene-4-phenyl-butanoate

Systemtic Name: methyl (2E,4S)-4-acetyloxy-2-[methoxy(oxidanyl)methylidene]-3-oxidanylidene-4-phenyl-butanoate Openeye Name: methyl (2E,4S)-4-acetoxy-2-[hydroxy(methoxy)methylene]-3-oxo-4-phenyl-butanoate CAS Name: (2E,4S)-4-acetyloxy-2-[hydroxy(methoxy)methylidene]-3-oxo-4-phenylbutanoic acid methyl ester IUPAC Name: methyl (2E,4S)-4-acetyloxy-2-[hydroxy(methoxy)methylidene]-3-oxo-4-phenylbutanoate Traditional Name: (E)-2-[(2S)-2-acetoxy-2-phenyl-acetyl]-3-hydroxy-3-methoxy-acrylic acid methyl ester Formula: C15H16O7 MolecularWeight: 308.28334

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=CC=C1)C(=O)C(=C(O)OC)C(=O)OC

Isomeric SMILES

CC(=O)O[C@@H](C1=CC=CC=C1)C(=O)/C(=C(/O)\OC)/C(=O)OC

InChI

InChI=1S/C15H16O7/c1-9(16)22-13(10-7-5-4-6-8-10)12(17)11(14(18)20-2)15(19)21-3/h4-8,13,18H,1-3H3/b14-11+/t13-/m0/s1