[3-(4-cyclohexylidene-5-oxidanylidene-furan-2-yl)phenyl] pentanoate

Systemtic Name: [3-(4-cyclohexylidene-5-oxidanylidene-furan-2-yl)phenyl] pentanoate Openeye Name: [3-(4-cyclohexylidene-5-oxo-2-furyl)phenyl] pentanoate CAS Name: pentanoic acid [3-(4-cyclohexylidene-5-oxo-2-furanyl)phenyl] ester IUPAC Name: [3-(4-cyclohexylidene-5-oxofuran-2-yl)phenyl] pentanoate Traditional Name: valeric acid [3-(4-cyclohexylidene-5-keto-2-furyl)phenyl] ester Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=CC=CC(=C1)C2=CC(=C3CCCCC3)C(=O)O2

Isomeric SMILES

CCCCC(=O)OC1=CC=CC(=C1)C2=CC(=C3CCCCC3)C(=O)O2

InChI

InChI=1S/C21H24O4/c1-2-3-12-20(22)24-17-11-7-10-16(13-17)19-14-18(21(23)25-19)15-8-5-4-6-9-15/h7,10-11,13-14H,2-6,8-9,12H2,1H3