(5-methyl-4-oxidanylidene-5-prop-2-enyl-furan-3-yl)methyl benzoate

Systemtic Name: (5-methyl-4-oxidanylidene-5-prop-2-enyl-furan-3-yl)methyl benzoate Openeye Name: (5-allyl-5-methyl-4-oxo-3-furyl)methyl benzoate CAS Name: benzoic acid (5-methyl-4-oxo-5-prop-2-enyl-3-furanyl)methyl ester IUPAC Name: (5-methyl-4-oxo-5-prop-2-enylfuran-3-yl)methyl benzoate Traditional Name: benzoic acid (5-allyl-4-keto-5-methyl-3-furyl)methyl ester Formula: C16H16O4 MolecularWeight: 272.29584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O4/c1-3-9-16(2)14(17)13(11-20-16)10-19-15(18)12-7-5-4-6-8-12/h3-8,11H,1,9-10H2,2H3