methyl (2R)-2-[4,4-dimethyl-2-(phenylselanylmethyl)-2,3-dihydropyrrol-1-ium-1-yl]-2-phenyl-ethanoate bromide

Systemtic Name: methyl (2R)-2-[4,4-dimethyl-2-(phenylselanylmethyl)-2,3-dihydropyrrol-1-ium-1-yl]-2-phenyl-ethanoate bromide Openeye Name: methyl (2R)-2-[4,4-dimethyl-2-(phenylselanylmethyl)-2,3-dihydropyrrol-1-ium-1-yl]-2-phenyl-acetate bromide CAS Name: (2R)-2-[4,4-dimethyl-2-[(phenylseleno)methyl]-2,3-dihydropyrrol-1-ium-1-yl]-2-phenylacetic acid methyl ester bromide IUPAC Name: methyl (2R)-2-[4,4-dimethyl-2-(phenylselanylmethyl)-2,3-dihydropyrrol-1-ium-1-yl]-2-phenylacetate bromide Traditional Name: (2R)-2-[4,4-dimethyl-2-[(phenylseleno)methyl]-1-pyrrolin-1-ium-1-yl]-2-phenyl-acetic acid methyl ester bromide Formula: C22H26BrNO2Se MolecularWeight: 495.31134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26NO2Se.BrH/c1-22(2)14-18(15-26-19-12-8-5-9-13-19)23(16-22)20(21(24)25-3)17-10-6-4-7-11-17;/h4-13,16,18,20H,14-15H2,1-3H3;1H/q+1;/p-1/t18?,20-;/m1./s1