2-butyl-3-deuterio-4-methyl-cyclohex-2-en-1-one

Systemtic Name: 2-butyl-3-deuterio-4-methyl-cyclohex-2-en-1-one Openeye Name: 2-butyl-3-deuterio-4-methyl-cyclohex-2-en-1-one CAS Name: 2-butyl-3-deuterio-4-methyl-1-cyclohex-2-enone IUPAC Name: 2-butyl-3-deuterio-4-methylcyclohex-2-en-1-one Traditional Name: 2-butyl-3-deuterio-4-methyl-cyclohex-2-en-1-one Formula: C11H18O MolecularWeight: 167.266182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(CCC1=O)C

Isomeric SMILES

[2H]C1=C(C(=O)CCC1C)CCCC

InChI

InChI=1S/C11H18O/c1-3-4-5-10-8-9(2)6-7-11(10)12/h8-9H,3-7H2,1-2H3/i8D