[(E,1S)-4-methoxy-1-[(2S)-2-methyloxiran-2-yl]-4-oxidanylidene-but-2-enyl] benzoate

Systemtic Name: [(E,1S)-4-methoxy-1-[(2S)-2-methyloxiran-2-yl]-4-oxidanylidene-but-2-enyl] benzoate Openeye Name: [(E,1S)-4-methoxy-1-[(2S)-2-methyloxiran-2-yl]-4-oxo-but-2-enyl] benzoate CAS Name: benzoic acid [(E,1S)-4-methoxy-1-[(2S)-2-methyl-2-oxiranyl]-4-oxobut-2-enyl] ester IUPAC Name: [(E,1S)-4-methoxy-1-[(2S)-2-methyloxiran-2-yl]-4-oxobut-2-enyl] benzoate Traditional Name: benzoic acid [(E,1S)-4-keto-4-methoxy-1-[(2S)-2-methyloxiran-2-yl]but-2-enyl] ester Formula: C15H16O5 MolecularWeight: 276.28454

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CO1)C(C=CC(=O)OC)OC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@]1(CO1)[C@H](/C=C/C(=O)OC)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H16O5/c1-15(10-19-15)12(8-9-13(16)18-2)20-14(17)11-6-4-3-5-7-11/h3-9,12H,10H2,1-2H3/b9-8+/t12-,15-/m0/s1