1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]butan-1-one

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]butan-1-one Openeye Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]butan-1-one CAS Name: 1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]butan-1-one Traditional Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazino]butan-1-one Formula: C15H21ClN2O MolecularWeight: 280.79304

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=C(C=CC(=C2)Cl)C

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=C(C=CC(=C2)Cl)C

InChI

InChI=1S/C15H21ClN2O/c1-3-4-15(19)18-9-7-17(8-10-18)14-11-13(16)6-5-12(14)2/h5-6,11H,3-4,7-10H2,1-2H3