3-butyl-4-phenyl-furan-2,5-dione

Systemtic Name: 3-butyl-4-phenyl-furan-2,5-dione Openeye Name: 3-butyl-4-phenyl-furan-2,5-dione CAS Name: 3-butyl-4-phenylfuran-2,5-dione IUPAC Name: 3-butyl-4-phenylfuran-2,5-dione Traditional Name: 3-butyl-4-phenyl-furan-2,5-quinone Formula: C14H14O3 MolecularWeight: 230.25916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)OC1=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=C(C(=O)OC1=O)C2=CC=CC=C2

InChI

InChI=1S/C14H14O3/c1-2-3-9-11-12(14(16)17-13(11)15)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3