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butyl-[(3-methoxy-4-oxidanyl-phenyl)methyl]azanium

butyl-[(3-methoxy-4-oxidanyl-phenyl)methyl]azanium

Systemtic Name:butyl-[(3-methoxy-4-oxidanyl-phenyl)methyl]azanium
Openeye Name:butyl-[(4-hydroxy-3-methoxy-phenyl)methyl]ammonium
CAS Name:butyl-[(4-hydroxy-3-methoxyphenyl)methyl]ammonium
IUPAC Name:butyl-[(4-hydroxy-3-methoxyphenyl)methyl]azanium
Traditional Name:butyl(vanillyl)ammonium
Formula: C12H20NO2+
MolecularWeight: 210.2927
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H19NO2/c1-3-4-7-13-9-10-5-6-11(14)12(8-10)15-2/h5-6,8,13-14H,3-4,7,9H2,1-2H3/p+1


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