[4-(3-bromanylpropoxy)-3-chloranyl-phenyl]-(2-butyl-1-benzofuran-3-yl)methanone

Systemtic Name: [4-(3-bromanylpropoxy)-3-chloranyl-phenyl]-(2-butyl-1-benzofuran-3-yl)methanone Openeye Name: [4-(3-bromopropoxy)-3-chloro-phenyl]-(2-butylbenzofuran-3-yl)methanone CAS Name: [4-(3-bromopropoxy)-3-chlorophenyl]-(2-butyl-3-benzofuranyl)methanone IUPAC Name: [4-(3-bromopropoxy)-3-chlorophenyl]-(2-butyl-1-benzofuran-3-yl)methanone Traditional Name: [4-(3-bromopropoxy)-3-chloro-phenyl]-(2-butylbenzofuran-3-yl)methanone Formula: C22H22BrClO3 MolecularWeight: 449.76528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C=C3)OCCCBr)Cl

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C=C3)OCCCBr)Cl

InChI

InChI=1S/C22H22BrClO3/c1-2-3-8-20-21(16-7-4-5-9-18(16)27-20)22(25)15-10-11-19(17(24)14-15)26-13-6-12-23/h4-5,7,9-11,14H,2-3,6,8,12-13H2,1H3