(3-bromophenyl)methyl-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: (3-bromophenyl)methyl-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: (3-bromophenyl)methyl-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: (3-bromophenyl)methyl-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: (3-bromophenyl)methyl-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: (3-bromobenzyl)-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C13H21BrN2O+2 MolecularWeight: 301.22264

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC[NH2+]CC2=CC(=CC=C2)Br

Isomeric SMILES

C1COCC[NH+]1CC[NH2+]CC2=CC(=CC=C2)Br

InChI

InChI=1S/C13H19BrN2O/c14-13-3-1-2-12(10-13)11-15-4-5-16-6-8-17-9-7-16/h1-3,10,15H,4-9,11H2/p+2