[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]-(2,6-dimethoxypyridin-3-yl)methanone

Systemtic Name: [4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]-(2,6-dimethoxypyridin-3-yl)methanone Openeye Name: [4-(4-bromophenyl)-4-hydroxy-1-piperidyl]-(2,6-dimethoxy-3-pyridyl)methanone CAS Name: [4-(4-bromophenyl)-4-hydroxy-1-piperidinyl]-(2,6-dimethoxy-3-pyridinyl)methanone IUPAC Name: [4-(4-bromophenyl)-4-hydroxypiperidin-1-yl]-(2,6-dimethoxypyridin-3-yl)methanone Traditional Name: [4-(4-bromophenyl)-4-hydroxy-piperidino]-(2,6-dimethoxy-3-pyridyl)methanone Formula: C19H21BrN2O4 MolecularWeight: 421.28504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1)C(=O)N2CCC(CC2)(C3=CC=C(C=C3)Br)O)OC

Isomeric SMILES

COC1=NC(=C(C=C1)C(=O)N2CCC(CC2)(C3=CC=C(C=C3)Br)O)OC

InChI

InChI=1S/C19H21BrN2O4/c1-25-16-8-7-15(17(21-16)26-2)18(23)22-11-9-19(24,10-12-22)13-3-5-14(20)6-4-13/h3-8,24H,9-12H2,1-2H3