[(3R,4R)-4-[(2S)-oxiran-2-yl]hexa-1,5-dien-3-yl] benzoate

Systemtic Name: [(3R,4R)-4-[(2S)-oxiran-2-yl]hexa-1,5-dien-3-yl] benzoate Openeye Name: [(1R,2R)-2-[(2S)-oxiran-2-yl]-1-vinyl-but-3-enyl] benzoate CAS Name: benzoic acid [(3R,4R)-4-[(2S)-2-oxiranyl]hexa-1,5-dien-3-yl] ester IUPAC Name: [(3R,4R)-4-[(2S)-oxiran-2-yl]hexa-1,5-dien-3-yl] benzoate Traditional Name: benzoic acid [(1R,2R)-2-[(2S)-oxiran-2-yl]-1-vinyl-but-3-enyl] ester Formula: C15H16O3 MolecularWeight: 244.28574

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C1CO1)C(C=C)OC(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C15H16O3/c1-3-12(14-10-17-14)13(4-2)18-15(16)11-8-6-5-7-9-11/h3-9,12-14H,1-2,10H2/t12-,13-,14-/m1/s1