(5-bromanyl-3-methoxy-2-phenylmethoxy-phenyl)methyl-tert-butyl-azanium

Systemtic Name: (5-bromanyl-3-methoxy-2-phenylmethoxy-phenyl)methyl-tert-butyl-azanium Openeye Name: (2-benzyloxy-5-bromo-3-methoxy-phenyl)methyl-tert-butyl-ammonium CAS Name: (5-bromo-3-methoxy-2-phenylmethoxyphenyl)methyl-tert-butylammonium IUPAC Name: (5-bromo-3-methoxy-2-phenylmethoxyphenyl)methyl-tert-butylazanium Traditional Name: (2-benzoxy-5-bromo-3-methoxy-benzyl)-tert-butyl-ammonium Formula: C19H25BrNO2+ MolecularWeight: 379.3113

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)Br

Isomeric SMILES

CC(C)(C)[NH2+]CC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)Br

InChI

InChI=1S/C19H24BrNO2/c1-19(2,3)21-12-15-10-16(20)11-17(22-4)18(15)23-13-14-8-6-5-7-9-14/h5-11,21H,12-13H2,1-4H3/p+1