(3,4-dimethoxyphenyl)methyl-(4-oxidanylbutyl)azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-(4-oxidanylbutyl)azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-(4-hydroxybutyl)ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-(4-hydroxybutyl)ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-(4-hydroxybutyl)azanium Traditional Name: 4-hydroxybutyl(veratryl)ammonium Formula: C13H22NO3+ MolecularWeight: 240.31868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]CCCCO)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]CCCCO)OC

InChI

InChI=1S/C13H21NO3/c1-16-12-6-5-11(9-13(12)17-2)10-14-7-3-4-8-15/h5-6,9,14-15H,3-4,7-8,10H2,1-2H3/p+1