(3-methoxy-4-oxidanyl-phenyl)methyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (3-methoxy-4-oxidanyl-phenyl)methyl-(pyridin-4-ylmethyl)azanium Openeye Name: (4-hydroxy-3-methoxy-phenyl)methyl-(4-pyridylmethyl)ammonium CAS Name: (4-hydroxy-3-methoxyphenyl)methyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (4-hydroxy-3-methoxyphenyl)methyl-(pyridin-4-ylmethyl)azanium Traditional Name: 4-pyridylmethyl(vanillyl)ammonium Formula: C14H17N2O2+ MolecularWeight: 245.29698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=NC=C2)O

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=NC=C2)O

InChI

InChI=1S/C14H16N2O2/c1-18-14-8-12(2-3-13(14)17)10-16-9-11-4-6-15-7-5-11/h2-8,16-17H,9-10H2,1H3/p+1