methyl (2R)-2-[5,5-dimethyl-2-(phenylselanylmethyl)-3,4-dihydro-2H-pyridin-1-ium-1-yl]-2-phenyl-ethanoate bromide

Systemtic Name: methyl (2R)-2-[5,5-dimethyl-2-(phenylselanylmethyl)-3,4-dihydro-2H-pyridin-1-ium-1-yl]-2-phenyl-ethanoate bromide Openeye Name: methyl (2R)-2-[5,5-dimethyl-2-(phenylselanylmethyl)-3,4-dihydro-2H-pyridin-1-ium-1-yl]-2-phenyl-acetate bromide CAS Name: (2R)-2-[5,5-dimethyl-2-[(phenylseleno)methyl]-3,4-dihydro-2H-pyridin-1-ium-1-yl]-2-phenylacetic acid methyl ester bromide IUPAC Name: methyl (2R)-2-[5,5-dimethyl-2-(phenylselanylmethyl)-3,4-dihydro-2H-pyridin-1-ium-1-yl]-2-phenylacetate bromide Traditional Name: (2R)-2-[5,5-dimethyl-2-[(phenylseleno)methyl]-3,4-dihydro-2H-pyridin-1-ium-1-yl]-2-phenyl-acetic acid methyl ester bromide Formula: C23H28BrNO2Se MolecularWeight: 509.33792

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC([N+](=C1)C(C2=CC=CC=C2)C(=O)OC)C[Se]C3=CC=CC=C3)C.[Br-]

Isomeric SMILES

CC1(CCC([N+](=C1)[C@H](C2=CC=CC=C2)C(=O)OC)C[Se]C3=CC=CC=C3)C.[Br-]

InChI

InChI=1S/C23H28NO2Se.BrH/c1-23(2)15-14-19(16-27-20-12-8-5-9-13-20)24(17-23)21(22(25)26-3)18-10-6-4-7-11-18;/h4-13,17,19,21H,14-16H2,1-3H3;1H/q+1;/p-1/t19?,21-;/m1./s1