2-methylcyclohexan-1-one; 3-methylcyclohexan-1-one; 4-methylcyclohexan-1-one

Systemtic Name: 2-methylcyclohexan-1-one; 3-methylcyclohexan-1-one; 4-methylcyclohexan-1-one Openeye Name: 2-methylcyclohexanone; 3-methylcyclohexanone; 4-methylcyclohexanone CAS Name: 2-methyl-1-cyclohexanone; 3-methyl-1-cyclohexanone; 4-methyl-1-cyclohexanone IUPAC Name: 2-methylcyclohexan-1-one; 3-methylcyclohexan-1-one; 4-methylcyclohexan-1-one Traditional Name: 2-methylcyclohexanone; 3-methylcyclohexanone; 4-methylcyclohexanone Formula: C21H36O3 MolecularWeight: 336.50874

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)CC1.CC1CCCC(=O)C1.CC1CCCCC1=O

Isomeric SMILES

CC1CCC(=O)CC1.CC1CCCC(=O)C1.CC1CCCCC1=O

InChI

InChI=1S/3C7H12O/c1-6-2-4-7(8)5-3-6;1-6-3-2-4-7(8)5-6;1-6-4-2-3-5-7(6)8/h3*6H,2-5H2,1H3