4-methyl-1-phenyl-heptane-1,2-dione

Systemtic Name: 4-methyl-1-phenyl-heptane-1,2-dione Openeye Name: 4-methyl-1-phenyl-heptane-1,2-dione CAS Name: 4-methyl-1-phenylheptane-1,2-dione IUPAC Name: 4-methyl-1-phenylheptane-1,2-dione Traditional Name: 4-methyl-1-phenyl-heptane-1,2-dione Formula: C14H18O2 MolecularWeight: 218.29152

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC(=O)C(=O)C1=CC=CC=C1

Isomeric SMILES

CCCC(C)CC(=O)C(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H18O2/c1-3-7-11(2)10-13(15)14(16)12-8-5-4-6-9-12/h4-6,8-9,11H,3,7,10H2,1-2H3