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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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