[3,5-bis(bromanyl)-2-methoxy-phenyl]methyl-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: [3,5-bis(bromanyl)-2-methoxy-phenyl]methyl-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: (3,5-dibromo-2-methoxy-phenyl)methyl-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: (3,5-dibromo-2-methoxyphenyl)methyl-[(2R)-1-hydroxybutan-2-yl]ammonium IUPAC Name: (3,5-dibromo-2-methoxyphenyl)methyl-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: (3,5-dibromo-2-methoxy-benzyl)-[(1R)-1-methylolpropyl]ammonium Formula: C12H18Br2NO2+ MolecularWeight: 368.08482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]CC1=CC(=CC(=C1OC)Br)Br

Isomeric SMILES

CC[C@H](CO)[NH2+]CC1=CC(=CC(=C1OC)Br)Br

InChI

InChI=1S/C12H17Br2NO2/c1-3-10(7-16)15-6-8-4-9(13)5-11(14)12(8)17-2/h4-5,10,15-16H,3,6-7H2,1-2H3/p+1/t10-/m1/s1