(2-bromophenyl)methyl-bis[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: (2-bromophenyl)methyl-bis[(2S)-2-oxidanylpropyl]azanium Openeye Name: (2-bromophenyl)methyl-bis[(2S)-2-hydroxypropyl]ammonium CAS Name: (2-bromophenyl)methyl-bis[(2S)-2-hydroxypropyl]ammonium IUPAC Name: (2-bromophenyl)methyl-bis[(2S)-2-hydroxypropyl]azanium Traditional Name: (2-bromobenzyl)-bis[(2S)-2-hydroxypropyl]ammonium Formula: C13H21BrNO2+ MolecularWeight: 303.21534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+](CC1=CC=CC=C1Br)CC(C)O)O

Isomeric SMILES

C[C@@H](C[NH+](CC1=CC=CC=C1Br)C[C@H](C)O)O

InChI

InChI=1S/C13H20BrNO2/c1-10(16)7-15(8-11(2)17)9-12-5-3-4-6-13(12)14/h3-6,10-11,16-17H,7-9H2,1-2H3/p+1/t10-,11-/m0/s1