(R)-methyl-[(2S)-1-oxidanylpropan-2-yl]-(phenylmethyl)-prop-2-enyl-azanium bromide

Systemtic Name: (R)-methyl-[(2S)-1-oxidanylpropan-2-yl]-(phenylmethyl)-prop-2-enyl-azanium bromide Openeye Name: (R)-allyl-benzyl-[(1S)-2-hydroxy-1-methyl-ethyl]-methyl-ammonium bromide CAS Name: (R)-[(2S)-1-hydroxypropan-2-yl]-methyl-(phenylmethyl)-prop-2-enylammonium bromide IUPAC Name: (R)-benzyl-[(2S)-1-hydroxypropan-2-yl]-methyl-prop-2-enylazanium bromide Traditional Name: (R)-allyl-benzyl-[(1S)-2-hydroxy-1-methyl-ethyl]-methyl-ammonium bromide Formula: C14H22BrNO MolecularWeight: 300.23458

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)[N+](C)(CC=C)CC1=CC=CC=C1.[Br-]

Isomeric SMILES

C[C@@H](CO)[N@+](C)(CC=C)CC1=CC=CC=C1.[Br-]

InChI

InChI=1S/C14H22NO.BrH/c1-4-10-15(3,13(2)12-16)11-14-8-6-5-7-9-14;/h4-9,13,16H,1,10-12H2,2-3H3;1H/q+1;/p-1/t13-,15+;/m0./s1