[2,4-bis(oxidanyl)phenyl]methyl-[(1-methylpyrazol-3-yl)methyl]azanium

Systemtic Name: [2,4-bis(oxidanyl)phenyl]methyl-[(1-methylpyrazol-3-yl)methyl]azanium Openeye Name: (2,4-dihydroxyphenyl)methyl-[(1-methylpyrazol-3-yl)methyl]ammonium CAS Name: (2,4-dihydroxyphenyl)methyl-[(1-methyl-3-pyrazolyl)methyl]ammonium IUPAC Name: (2,4-dihydroxyphenyl)methyl-[(1-methylpyrazol-3-yl)methyl]azanium Traditional Name: (2,4-dihydroxybenzyl)-[(1-methylpyrazol-3-yl)methyl]ammonium Formula: C12H16N3O2+ MolecularWeight: 234.27434

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C[NH2+]CC2=C(C=C(C=C2)O)O

Isomeric SMILES

CN1C=CC(=N1)C[NH2+]CC2=C(C=C(C=C2)O)O

InChI

InChI=1S/C12H15N3O2/c1-15-5-4-10(14-15)8-13-7-9-2-3-11(16)6-12(9)17/h2-6,13,16-17H,7-8H2,1H3/p+1