(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-(2-methylpropyl)azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-(2-methylpropyl)azanium Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)methyl-isobutyl-ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-(2-methylpropyl)ammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-(2-methylpropyl)azanium Traditional Name: (3-bromo-4-hydroxy-5-methoxy-benzyl)-isobutyl-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/c1-8(2)6-14-7-9-4-10(13)12(15)11(5-9)16-3/h4-5,8,14-15H,6-7H2,1-3H3/p+1