6-chloranyl-1-(3-methylphenyl)hexan-1-one

Systemtic Name: 6-chloranyl-1-(3-methylphenyl)hexan-1-one Openeye Name: 6-chloro-1-(m-tolyl)hexan-1-one CAS Name: 6-chloro-1-(3-methylphenyl)-1-hexanone IUPAC Name: 6-chloro-1-(3-methylphenyl)hexan-1-one Traditional Name: 6-chloro-1-(m-tolyl)hexan-1-one Formula: C13H17ClO MolecularWeight: 224.72648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)CCCCCCl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)CCCCCCl

InChI

InChI=1S/C13H17ClO/c1-11-6-5-7-12(10-11)13(15)8-3-2-4-9-14/h5-7,10H,2-4,8-9H2,1H3