[3,4-bis(oxidanyl)phenyl]methyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: [3,4-bis(oxidanyl)phenyl]methyl-(pyridin-4-ylmethyl)azanium Openeye Name: (3,4-dihydroxyphenyl)methyl-(4-pyridylmethyl)ammonium CAS Name: (3,4-dihydroxyphenyl)methyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (3,4-dihydroxyphenyl)methyl-(pyridin-4-ylmethyl)azanium Traditional Name: protocatechuyl(4-pyridylmethyl)ammonium Formula: C13H15N2O2+ MolecularWeight: 231.2704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C[NH2+]CC2=CC=NC=C2)O)O

Isomeric SMILES

C1=CC(=C(C=C1C[NH2+]CC2=CC=NC=C2)O)O

InChI

InChI=1S/C13H14N2O2/c16-12-2-1-11(7-13(12)17)9-15-8-10-3-5-14-6-4-10/h1-7,15-17H,8-9H2/p+1