(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-tert-butyl-azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-tert-butyl-azanium Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)methyl-tert-butyl-ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-tert-butylammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-tert-butylazanium Traditional Name: (3-bromo-4-hydroxy-5-methoxy-benzyl)-tert-butyl-ammonium Formula: C12H19BrNO2+ MolecularWeight: 289.18876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC1=CC(=C(C(=C1)Br)O)OC

Isomeric SMILES

CC(C)(C)[NH2+]CC1=CC(=C(C(=C1)Br)O)OC

InChI

InChI=1S/C12H18BrNO2/c1-12(2,3)14-7-8-5-9(13)11(15)10(6-8)16-4/h5-6,14-15H,7H2,1-4H3/p+1