cyclohexanone; 4-methylpentan-2-one; propan-2-one

Systemtic Name: cyclohexanone; 4-methylpentan-2-one; propan-2-one Openeye Name: acetone; cyclohexanone; 4-methylpentan-2-one CAS Name: cyclohexanone; 4-methyl-2-pentanone; 2-propanone IUPAC Name: cyclohexanone; 4-methylpentan-2-one; propan-2-one Traditional Name: acetone; cyclohexanone; 4-methylpentan-2-one Formula: C15H28O3 MolecularWeight: 256.38102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C.CC(=O)C.C1CCC(=O)CC1

Isomeric SMILES

CC(C)CC(=O)C.CC(=O)C.C1CCC(=O)CC1

InChI

InChI=1S/C6H10O.C6H12O.C3H6O/c7-6-4-2-1-3-5-6;1-5(2)4-6(3)7;1-3(2)4/h1-5H2;5H,4H2,1-3H3;1-2H3