2-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methylamino]ethyl-(2-hydroxyethyl)azanium

Systemtic Name: 2-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methylamino]ethyl-(2-hydroxyethyl)azanium Openeye Name: 2-[(3,5-dibromo-2-methoxy-phenyl)methylamino]ethyl-(2-hydroxyethyl)ammonium CAS Name: 2-[(3,5-dibromo-2-methoxyphenyl)methylamino]ethyl-(2-hydroxyethyl)ammonium IUPAC Name: 2-[(3,5-dibromo-2-methoxyphenyl)methylamino]ethyl-(2-hydroxyethyl)azanium Traditional Name: 2-[(3,5-dibromo-2-methoxy-benzyl)amino]ethyl-(2-hydroxyethyl)ammonium Formula: C12H19Br2N2O2+ MolecularWeight: 383.09946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1CNCC[NH2+]CCO)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1CNCC[NH2+]CCO)Br)Br

InChI

InChI=1S/C12H18Br2N2O2/c1-18-12-9(6-10(13)7-11(12)14)8-16-3-2-15-4-5-17/h6-7,15-17H,2-5,8H2,1H3/p+1