(2S)-2-[(1R)-2-methylidene-1-(4-methylphenyl)-3-oxidanylidene-butyl]-2H-furan-5-one

Systemtic Name: (2S)-2-[(1R)-2-methylidene-1-(4-methylphenyl)-3-oxidanylidene-butyl]-2H-furan-5-one Openeye Name: (2S)-2-[(1R)-2-methylene-3-oxo-1-(p-tolyl)butyl]-2H-furan-5-one CAS Name: (2S)-2-[(1R)-2-methylene-1-(4-methylphenyl)-3-oxobutyl]-2H-furan-5-one IUPAC Name: (2S)-2-[(1R)-2-methylidene-1-(4-methylphenyl)-3-oxobutyl]-2H-furan-5-one Traditional Name: (2S)-2-[(1R)-2-acetyl-1-(p-tolyl)allyl]-2H-furan-5-one Formula: C16H16O3 MolecularWeight: 256.29644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2C=CC(=O)O2)C(=C)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]([C@@H]2C=CC(=O)O2)C(=C)C(=O)C

InChI

InChI=1S/C16H16O3/c1-10-4-6-13(7-5-10)16(11(2)12(3)17)14-8-9-15(18)19-14/h4-9,14,16H,2H2,1,3H3/t14-,16-/m0/s1