3-chloranyl-1-[4-hexoxy-3-(phenylmethyl)phenyl]propan-1-one

Systemtic Name: 3-chloranyl-1-[4-hexoxy-3-(phenylmethyl)phenyl]propan-1-one Openeye Name: 1-(3-benzyl-4-hexoxy-phenyl)-3-chloro-propan-1-one CAS Name: 3-chloro-1-[4-hexoxy-3-(phenylmethyl)phenyl]-1-propanone IUPAC Name: 1-(3-benzyl-4-hexoxyphenyl)-3-chloropropan-1-one Traditional Name: 1-(3-benzyl-4-hexoxy-phenyl)-3-chloro-propan-1-one Formula: C22H27ClO2 MolecularWeight: 358.90158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)CCCl)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)CCCl)CC2=CC=CC=C2

InChI

InChI=1S/C22H27ClO2/c1-2-3-4-8-15-25-22-12-11-19(21(24)13-14-23)17-20(22)16-18-9-6-5-7-10-18/h5-7,9-12,17H,2-4,8,13-16H2,1H3