2,6,6-trimethyl-3-propyl-cyclohept-4-en-1-one

Systemtic Name: 2,6,6-trimethyl-3-propyl-cyclohept-4-en-1-one Openeye Name: 2,6,6-trimethyl-3-propyl-cyclohept-4-en-1-one CAS Name: 2,6,6-trimethyl-3-propyl-1-cyclohept-4-enone IUPAC Name: 2,6,6-trimethyl-3-propylcyclohept-4-en-1-one Traditional Name: 2,6,6-trimethyl-3-propyl-cyclohept-4-en-1-one Formula: C13H22O MolecularWeight: 194.31318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C=CC(CC(=O)C1C)(C)C

Isomeric SMILES

CCCC1C=CC(CC(=O)C1C)(C)C

InChI

InChI=1S/C13H22O/c1-5-6-11-7-8-13(3,4)9-12(14)10(11)2/h7-8,10-11H,5-6,9H2,1-4H3