cycloheptane-1,3,5-trione; propan-2-one

Systemtic Name: cycloheptane-1,3,5-trione; propan-2-one Openeye Name: acetone; cycloheptane-1,3,5-trione CAS Name: cycloheptane-1,3,5-trione; 2-propanone IUPAC Name: cycloheptane-1,3,5-trione; propan-2-one Traditional Name: acetone; cycloheptane-1,3,5-trione Formula: C10H14O4 MolecularWeight: 198.21576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C.C1CC(=O)CC(=O)CC1=O

Isomeric SMILES

CC(=O)C.C1CC(=O)CC(=O)CC1=O

InChI

InChI=1S/C7H8O3.C3H6O/c8-5-1-2-6(9)4-7(10)3-5;1-3(2)4/h1-4H2;1-2H3