(3-bromanyl-4,5-diethoxy-phenyl)methyl-(2-methylpropyl)azanium

Systemtic Name: (3-bromanyl-4,5-diethoxy-phenyl)methyl-(2-methylpropyl)azanium Openeye Name: (3-bromo-4,5-diethoxy-phenyl)methyl-isobutyl-ammonium CAS Name: (3-bromo-4,5-diethoxyphenyl)methyl-(2-methylpropyl)ammonium IUPAC Name: (3-bromo-4,5-diethoxyphenyl)methyl-(2-methylpropyl)azanium Traditional Name: (3-bromo-4,5-diethoxy-benzyl)-isobutyl-ammonium Formula: C15H25BrNO2+ MolecularWeight: 331.2685

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CC(C)C)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CC(C)C)Br)OCC

InChI

InChI=1S/C15H24BrNO2/c1-5-18-14-8-12(10-17-9-11(3)4)7-13(16)15(14)19-6-2/h7-8,11,17H,5-6,9-10H2,1-4H3/p+1