(2-azanyl-2-oxidanylidene-ethyl)-[2-(4-bromanylphenoxy)ethyl]-propan-2-yl-azanium

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl)-[2-(4-bromanylphenoxy)ethyl]-propan-2-yl-azanium Openeye Name: (2-amino-2-oxo-ethyl)-[2-(4-bromophenoxy)ethyl]-isopropyl-ammonium CAS Name: (2-amino-2-oxoethyl)-[2-(4-bromophenoxy)ethyl]-propan-2-ylammonium IUPAC Name: (2-amino-2-oxoethyl)-[2-(4-bromophenoxy)ethyl]-propan-2-ylazanium Traditional Name: (2-amino-2-keto-ethyl)-[2-(4-bromophenoxy)ethyl]-isopropyl-ammonium Formula: C13H20BrN2O2+ MolecularWeight: 316.2141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCOC1=CC=C(C=C1)Br)CC(=O)N

Isomeric SMILES

CC(C)[NH+](CCOC1=CC=C(C=C1)Br)CC(=O)N

InChI

InChI=1S/C13H19BrN2O2/c1-10(2)16(9-13(15)17)7-8-18-12-5-3-11(14)4-6-12/h3-6,10H,7-9H2,1-2H3,(H2,15,17)/p+1