(5-bromanyl-2-ethoxy-phenyl)methyl-(2-dimethylaminoethyl)azanium

Systemtic Name: (5-bromanyl-2-ethoxy-phenyl)methyl-(2-dimethylaminoethyl)azanium Openeye Name: (5-bromo-2-ethoxy-phenyl)methyl-(2-dimethylaminoethyl)ammonium CAS Name: (5-bromo-2-ethoxyphenyl)methyl-(2-dimethylaminoethyl)ammonium IUPAC Name: (5-bromo-2-ethoxyphenyl)methyl-(2-dimethylaminoethyl)azanium Traditional Name: (5-bromo-2-ethoxy-benzyl)-(2-dimethylaminoethyl)ammonium Formula: C13H22BrN2O+ MolecularWeight: 302.23058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C[NH2+]CCN(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C[NH2+]CCN(C)C

InChI

InChI=1S/C13H21BrN2O/c1-4-17-13-6-5-12(14)9-11(13)10-15-7-8-16(2)3/h5-6,9,15H,4,7-8,10H2,1-3H3/p+1