(5-bromanyl-2-phenylmethoxy-phenyl)methyl-butyl-azanium

Systemtic Name: (5-bromanyl-2-phenylmethoxy-phenyl)methyl-butyl-azanium Openeye Name: (2-benzyloxy-5-bromo-phenyl)methyl-butyl-ammonium CAS Name: (5-bromo-2-phenylmethoxyphenyl)methyl-butylammonium IUPAC Name: (5-bromo-2-phenylmethoxyphenyl)methyl-butylazanium Traditional Name: (2-benzoxy-5-bromo-benzyl)-butyl-ammonium Formula: C18H23BrNO+ MolecularWeight: 349.28532

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2

Isomeric SMILES

CCCC[NH2+]CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2

InChI

InChI=1S/C18H22BrNO/c1-2-3-11-20-13-16-12-17(19)9-10-18(16)21-14-15-7-5-4-6-8-15/h4-10,12,20H,2-3,11,13-14H2,1H3/p+1