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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C1=NN(C=C1)C)[NH2+]CC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C14H19N3O2/c1-10(12-6-7-17(2)16-12)15-9-11-4-5-13(18)14(8-11)19-3/h4-8,10,15,18H,9H2,1-3H3/p+1/t10-/m1/s1