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

Systemtic Name: [2-(2-azanyl-2-oxidanylidene-ethoxy)-5-bromanyl-phenyl]methyl-prop-2-enyl-azanium Openeye Name: allyl-[[2-(2-amino-2-oxo-ethoxy)-5-bromo-phenyl]methyl]ammonium CAS Name: [2-(2-amino-2-oxoethoxy)-5-bromophenyl]methyl-prop-2-enylammonium IUPAC Name: [2-(2-amino-2-oxoethoxy)-5-bromophenyl]methyl-prop-2-enylazanium Traditional Name: allyl-[2-(2-amino-2-keto-ethoxy)-5-bromo-benzyl]ammonium Formula: C12H16BrN2O2+ MolecularWeight: 300.17164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15BrN2O2/c1-2-5-15-7-9-6-10(13)3-4-11(9)17-8-12(14)16/h2-4,6,15H,1,5,7-8H2,(H2,14,16)/p+1