4-chloranyl-3,3,6-trimethyl-hept-5-en-2-one

Systemtic Name: 4-chloranyl-3,3,6-trimethyl-hept-5-en-2-one Openeye Name: 4-chloro-3,3,6-trimethyl-hept-5-en-2-one CAS Name: 4-chloro-3,3,6-trimethyl-5-hepten-2-one IUPAC Name: 4-chloro-3,3,6-trimethylhept-5-en-2-one Traditional Name: 4-chloro-3,3,6-trimethyl-hept-5-en-2-one Formula: C10H17ClO MolecularWeight: 188.69438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(C(C)(C)C(=O)C)Cl)C

Isomeric SMILES

CC(=CC(C(C)(C)C(=O)C)Cl)C

InChI

InChI=1S/C10H17ClO/c1-7(2)6-9(11)10(4,5)8(3)12/h6,9H,1-5H3