(8-chloranyl-7-oxidanylidene-6-bicyclo[4.2.0]octanyl) 2,4,6-trimethylbenzoate

Systemtic Name: (8-chloranyl-7-oxidanylidene-6-bicyclo[4.2.0]octanyl) 2,4,6-trimethylbenzoate Openeye Name: (8-chloro-7-oxo-6-bicyclo[4.2.0]octanyl) 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid (8-chloro-7-oxo-6-bicyclo[4.2.0]octanyl) ester IUPAC Name: (8-chloro-7-oxo-6-bicyclo[4.2.0]octanyl) 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid (8-chloro-7-keto-6-bicyclo[4.2.0]octanyl) ester Formula: C18H21ClO3 MolecularWeight: 320.81054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)OC23CCCCC2C(C3=O)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)OC23CCCCC2C(C3=O)Cl)C

InChI

InChI=1S/C18H21ClO3/c1-10-8-11(2)14(12(3)9-10)17(21)22-18-7-5-4-6-13(18)15(19)16(18)20/h8-9,13,15H,4-7H2,1-3H3