2-(bromomethyl)-1-[(2S)-1-methoxy-3-methyl-butan-2-yl]-4,4-dimethyl-2,3-dihydropyrrol-1-ium

Systemtic Name: 2-(bromomethyl)-1-[(2S)-1-methoxy-3-methyl-butan-2-yl]-4,4-dimethyl-2,3-dihydropyrrol-1-ium Openeye Name: 2-(bromomethyl)-1-[(1S)-1-(methoxymethyl)-2-methyl-propyl]-4,4-dimethyl-2,3-dihydropyrrol-1-ium CAS Name: 2-(bromomethyl)-1-[(2S)-1-methoxy-3-methylbutan-2-yl]-4,4-dimethyl-2,3-dihydropyrrol-1-ium IUPAC Name: 2-(bromomethyl)-1-[(2S)-1-methoxy-3-methylbutan-2-yl]-4,4-dimethyl-2,3-dihydropyrrol-1-ium Traditional Name: 2-(bromomethyl)-1-[(1S)-1-(methoxymethyl)-2-methyl-propyl]-4,4-dimethyl-1-pyrrolin-1-ium Formula: C13H25BrNO+ MolecularWeight: 291.2477

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(COC)[N+]1=CC(CC1CBr)(C)C

Isomeric SMILES

CC(C)[C@@H](COC)[N+]1=CC(CC1CBr)(C)C

InChI

InChI=1S/C13H25BrNO/c1-10(2)12(8-16-5)15-9-13(3,4)6-11(15)7-14/h9-12H,6-8H2,1-5H3/q+1/t11?,12-/m1/s1