7-[(4-chlorophenyl)methyl]-2,2-dimethyl-cycloheptan-1-one

Systemtic Name: 7-[(4-chlorophenyl)methyl]-2,2-dimethyl-cycloheptan-1-one Openeye Name: 7-[(4-chlorophenyl)methyl]-2,2-dimethyl-cycloheptanone CAS Name: 7-[(4-chlorophenyl)methyl]-2,2-dimethyl-1-cycloheptanone IUPAC Name: 7-[(4-chlorophenyl)methyl]-2,2-dimethylcycloheptan-1-one Traditional Name: 7-(4-chlorobenzyl)-2,2-dimethyl-cycloheptanone Formula: C16H21ClO MolecularWeight: 264.79034

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC(C1=O)CC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1(CCCCC(C1=O)CC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C16H21ClO/c1-16(2)10-4-3-5-13(15(16)18)11-12-6-8-14(17)9-7-12/h6-9,13H,3-5,10-11H2,1-2H3