[3,5-bis(bromanyl)-4-ethoxy-phenyl]methyl-[2-(2-hydroxyethyloxy)ethyl]azanium

Systemtic Name: [3,5-bis(bromanyl)-4-ethoxy-phenyl]methyl-[2-(2-hydroxyethyloxy)ethyl]azanium Openeye Name: (3,5-dibromo-4-ethoxy-phenyl)methyl-[2-(2-hydroxyethoxy)ethyl]ammonium CAS Name: (3,5-dibromo-4-ethoxyphenyl)methyl-[2-(2-hydroxyethoxy)ethyl]ammonium IUPAC Name: (3,5-dibromo-4-ethoxyphenyl)methyl-[2-(2-hydroxyethoxy)ethyl]azanium Traditional Name: (3,5-dibromo-4-ethoxy-benzyl)-[2-(2-hydroxyethoxy)ethyl]ammonium Formula: C13H20Br2NO3+ MolecularWeight: 398.1108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C[NH2+]CCOCCO)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C[NH2+]CCOCCO)Br

InChI

InChI=1S/C13H19Br2NO3/c1-2-19-13-11(14)7-10(8-12(13)15)9-16-3-5-18-6-4-17/h7-8,16-17H,2-6,9H2,1H3/p+1