[(E,4S)-1-oxidanylidene-1-phenyl-dodec-2-en-4-yl] ethanoate

Systemtic Name: [(E,4S)-1-oxidanylidene-1-phenyl-dodec-2-en-4-yl] ethanoate Openeye Name: [(1S)-1-[(E)-3-oxo-3-phenyl-prop-1-enyl]nonyl] acetate CAS Name: acetic acid [(E,4S)-1-oxo-1-phenyldodec-2-en-4-yl] ester IUPAC Name: [(E,4S)-1-oxo-1-phenyldodec-2-en-4-yl] acetate Traditional Name: acetic acid [(E,1S)-4-keto-1-octyl-4-phenyl-but-2-enyl] ester Formula: C20H28O3 MolecularWeight: 316.43452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28O3/c1-3-4-5-6-7-11-14-19(23-17(2)21)15-16-20(22)18-12-9-8-10-13-18/h8-10,12-13,15-16,19H,3-7,11,14H2,1-2H3/b16-15+/t19-/m0/s1