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

Systemtic Name: 3-[4-[(2-methylphenyl)methyl]piperazin-1-yl]carbonylbicyclo[3.3.1]nonan-9-one Openeye Name: 3-[4-(o-tolylmethyl)piperazine-1-carbonyl]bicyclo[3.3.1]nonan-9-one CAS Name: 3-[[4-[(2-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]-9-bicyclo[3.3.1]nonanone IUPAC Name: 3-[4-[(2-methylphenyl)methyl]piperazine-1-carbonyl]bicyclo[3.3.1]nonan-9-one Traditional Name: 3-[4-(2-methylbenzyl)piperazine-1-carbonyl]bicyclo[3.3.1]nonan-9-one Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3CC4CCCC(C3)C4=O

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3CC4CCCC(C3)C4=O

InChI

InChI=1S/C22H30N2O2/c1-16-5-2-3-6-19(16)15-23-9-11-24(12-10-23)22(26)20-13-17-7-4-8-18(14-20)21(17)25/h2-3,5-6,17-18,20H,4,7-15H2,1H3