[5-bromanyl-3-[2-(3,5-dimethylphenyl)ethyl]pyridin-2-yl]-(1-methylpiperidin-4-yl)methanone

Systemtic Name: [5-bromanyl-3-[2-(3,5-dimethylphenyl)ethyl]pyridin-2-yl]-(1-methylpiperidin-4-yl)methanone Openeye Name: [5-bromo-3-[2-(3,5-dimethylphenyl)ethyl]-2-pyridyl]-(1-methyl-4-piperidyl)methanone CAS Name: [5-bromo-3-[2-(3,5-dimethylphenyl)ethyl]-2-pyridinyl]-(1-methyl-4-piperidinyl)methanone IUPAC Name: [5-bromo-3-[2-(3,5-dimethylphenyl)ethyl]pyridin-2-yl]-(1-methylpiperidin-4-yl)methanone Traditional Name: [5-bromo-3-[2-(3,5-dimethylphenyl)ethyl]-2-pyridyl]-(1-methyl-4-piperidyl)methanone Formula: C22H27BrN2O MolecularWeight: 415.36658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CCC2=CC(=CN=C2C(=O)C3CCN(CC3)C)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)CCC2=CC(=CN=C2C(=O)C3CCN(CC3)C)Br)C

InChI

InChI=1S/C22H27BrN2O/c1-15-10-16(2)12-17(11-15)4-5-19-13-20(23)14-24-21(19)22(26)18-6-8-25(3)9-7-18/h10-14,18H,4-9H2,1-3H3