3-(4-butylphenyl)-4-(2-methylpropyl)furan-2,5-dione

Systemtic Name: 3-(4-butylphenyl)-4-(2-methylpropyl)furan-2,5-dione Openeye Name: 3-(4-butylphenyl)-4-isobutyl-furan-2,5-dione CAS Name: 3-(4-butylphenyl)-4-(2-methylpropyl)furan-2,5-dione IUPAC Name: 3-(4-butylphenyl)-4-(2-methylpropyl)furan-2,5-dione Traditional Name: 3-(4-butylphenyl)-4-isobutyl-furan-2,5-quinone Formula: C18H22O3 MolecularWeight: 286.36548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=C(C(=O)OC2=O)CC(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=C(C(=O)OC2=O)CC(C)C

InChI

InChI=1S/C18H22O3/c1-4-5-6-13-7-9-14(10-8-13)16-15(11-12(2)3)17(19)21-18(16)20/h7-10,12H,4-6,11H2,1-3H3