3-(2-chloroethyl)-5-(2-methylphenyl)pyran-4-one

Systemtic Name: 3-(2-chloroethyl)-5-(2-methylphenyl)pyran-4-one Openeye Name: 3-(2-chloroethyl)-5-(o-tolyl)pyran-4-one CAS Name: 3-(2-chloroethyl)-5-(2-methylphenyl)-4-pyranone IUPAC Name: 3-(2-chloroethyl)-5-(2-methylphenyl)pyran-4-one Traditional Name: 3-(2-chloroethyl)-5-(o-tolyl)pyran-4-one Formula: C14H13ClO2 MolecularWeight: 248.70482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=COC=C(C2=O)CCCl

Isomeric SMILES

CC1=CC=CC=C1C2=COC=C(C2=O)CCCl

InChI

InChI=1S/C14H13ClO2/c1-10-4-2-3-5-12(10)13-9-17-8-11(6-7-15)14(13)16/h2-5,8-9H,6-7H2,1H3