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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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