(4-butoxy-3-methoxy-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: (4-butoxy-3-methoxy-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: (4-butoxy-3-methoxy-phenyl)methyl-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: (4-butoxy-3-methoxyphenyl)methyl-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: (4-butoxy-3-methoxyphenyl)methyl-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: (4-butoxy-3-methoxy-benzyl)-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C16H28NO3+ MolecularWeight: 282.39842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C[NH2+]C(C)(C)CO)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C[NH2+]C(C)(C)CO)OC

InChI

InChI=1S/C16H27NO3/c1-5-6-9-20-14-8-7-13(10-15(14)19-4)11-17-16(2,3)12-18/h7-8,10,17-18H,5-6,9,11-12H2,1-4H3/p+1