1-(furan-2-yl)butane-1,3-dione; 1-phenylbutane-1,3-dione; 1-phenylpentane-2,4-dione

Systemtic Name: 1-(furan-2-yl)butane-1,3-dione; 1-phenylbutane-1,3-dione; 1-phenylpentane-2,4-dione Openeye Name: 1-(2-furyl)butane-1,3-dione; 1-phenylbutane-1,3-dione; 1-phenylpentane-2,4-dione CAS Name: 1-(2-furanyl)butane-1,3-dione; 1-phenylbutane-1,3-dione; 1-phenylpentane-2,4-dione IUPAC Name: 1-(furan-2-yl)butane-1,3-dione; 1-phenylbutane-1,3-dione; 1-phenylpentane-2,4-dione Traditional Name: 1-(2-furyl)butane-1,3-dione; 1-phenylbutane-1,3-dione; 1-phenylpentane-2,4-dione Formula: C29H30O7 MolecularWeight: 490.5443

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)CC1=CC=CC=C1.CC(=O)CC(=O)C1=CC=CC=C1.CC(=O)CC(=O)C1=CC=CO1

Isomeric SMILES

CC(=O)CC(=O)CC1=CC=CC=C1.CC(=O)CC(=O)C1=CC=CC=C1.CC(=O)CC(=O)C1=CC=CO1

InChI

InChI=1S/C11H12O2.C10H10O2.C8H8O3/c1-9(12)7-11(13)8-10-5-3-2-4-6-10;1-8(11)7-10(12)9-5-3-2-4-6-9;1-6(9)5-7(10)8-3-2-4-11-8/h2-6H,7-8H2,1H3;2-6H,7H2,1H3;2-4H,5H2,1H3