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

Systemtic Name: (3-methoxy-2-oxidanyl-phenyl)methyl-[(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: (2-hydroxy-3-methoxy-phenyl)methyl-[(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: (2-hydroxy-3-methoxyphenyl)methyl-[(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: (2-hydroxy-3-methoxyphenyl)methyl-[(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: (2-hydroxy-3-methoxy-benzyl)-[(1-methylpyrazol-4-yl)methyl]ammonium Formula: C13H18N3O2+ MolecularWeight: 248.30092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O2/c1-16-9-10(7-15-16)6-14-8-11-4-3-5-12(18-2)13(11)17/h3-5,7,9,14,17H,6,8H2,1-2H3/p+1