[2-(2-azanyl-2-oxidanylidene-ethoxy)-5-bromanyl-phenyl]methyl-propyl-azanium

Systemtic Name: [2-(2-azanyl-2-oxidanylidene-ethoxy)-5-bromanyl-phenyl]methyl-propyl-azanium Openeye Name: [2-(2-amino-2-oxo-ethoxy)-5-bromo-phenyl]methyl-propyl-ammonium CAS Name: [2-(2-amino-2-oxoethoxy)-5-bromophenyl]methyl-propylammonium IUPAC Name: [2-(2-amino-2-oxoethoxy)-5-bromophenyl]methyl-propylazanium Traditional Name: [2-(2-amino-2-keto-ethoxy)-5-bromo-benzyl]-propyl-ammonium Formula: C12H18BrN2O2+ MolecularWeight: 302.18752

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC1=C(C=CC(=C1)Br)OCC(=O)N

Isomeric SMILES

CCC[NH2+]CC1=C(C=CC(=C1)Br)OCC(=O)N

InChI

InChI=1S/C12H17BrN2O2/c1-2-5-15-7-9-6-10(13)3-4-11(9)17-8-12(14)16/h3-4,6,15H,2,5,7-8H2,1H3,(H2,14,16)/p+1