3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonylbicyclo[3.3.1]nonan-9-one

Systemtic Name: 3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonylbicyclo[3.3.1]nonan-9-one Openeye Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]bicyclo[3.3.1]nonan-9-one CAS Name: 3-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-oxomethyl]-9-bicyclo[3.3.1]nonanone IUPAC Name: 3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]bicyclo[3.3.1]nonan-9-one Traditional Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]bicyclo[3.3.1]nonan-9-one Formula: C21H27ClN2O2 MolecularWeight: 374.90428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CC4CCCC(C3)C4=O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CC4CCCC(C3)C4=O

InChI

InChI=1S/C21H27ClN2O2/c1-14-5-6-18(22)13-19(14)23-7-9-24(10-8-23)21(26)17-11-15-3-2-4-16(12-17)20(15)25/h5-6,13,15-17H,2-4,7-12H2,1H3