[(E,1S)-1-(5-oxidanylidene-2H-furan-2-yl)but-2-enyl] (2R)-2-phenylbutanoate

Systemtic Name: [(E,1S)-1-(5-oxidanylidene-2H-furan-2-yl)but-2-enyl] (2R)-2-phenylbutanoate Openeye Name: [(E,1S)-1-(5-oxo-2H-furan-2-yl)but-2-enyl] (2R)-2-phenylbutanoate CAS Name: (2R)-2-phenylbutanoic acid [(E,1S)-1-(5-oxo-2H-furan-2-yl)but-2-enyl] ester IUPAC Name: [(E,1S)-1-(5-oxo-2H-furan-2-yl)but-2-enyl] (2R)-2-phenylbutanoate Traditional Name: (2R)-2-phenylbutyric acid [(E,1S)-1-(5-keto-2H-furan-2-yl)but-2-enyl] ester Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OC(C=CC)C2C=CC(=O)O2

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)C(=O)O[C@@H](/C=C/C)C2C=CC(=O)O2

InChI

InChI=1S/C18H20O4/c1-3-8-15(16-11-12-17(19)21-16)22-18(20)14(4-2)13-9-6-5-7-10-13/h3,5-12,14-16H,4H2,1-2H3/b8-3+/t14-,15+,16?/m1/s1