(1,5-dimethylpyrazol-4-yl)methyl-[(3-methoxy-4-oxidanyl-phenyl)methyl]azanium

Systemtic Name: (1,5-dimethylpyrazol-4-yl)methyl-[(3-methoxy-4-oxidanyl-phenyl)methyl]azanium Openeye Name: (1,5-dimethylpyrazol-4-yl)methyl-[(4-hydroxy-3-methoxy-phenyl)methyl]ammonium CAS Name: (1,5-dimethyl-4-pyrazolyl)methyl-[(4-hydroxy-3-methoxyphenyl)methyl]ammonium IUPAC Name: (1,5-dimethylpyrazol-4-yl)methyl-[(4-hydroxy-3-methoxyphenyl)methyl]azanium Traditional Name: (1,5-dimethylpyrazol-4-yl)methyl-vanillyl-ammonium Formula: C14H20N3O2+ MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C[NH2+]CC2=CC(=C(C=C2)O)OC

Isomeric SMILES

CC1=C(C=NN1C)C[NH2+]CC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C14H19N3O2/c1-10-12(9-16-17(10)2)8-15-7-11-4-5-13(18)14(6-11)19-3/h4-6,9,15,18H,7-8H2,1-3H3/p+1