(3,5-dimethoxy-4-oxidanyl-phenyl)methyl-[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]azanium

Systemtic Name: (3,5-dimethoxy-4-oxidanyl-phenyl)methyl-[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]azanium Openeye Name: [(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]ammonium CAS Name: [(1S)-1-(1-ethyl-3-methyl-4-pyrazolyl)ethyl]-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]ammonium IUPAC Name: [(1S)-1-(1-ethyl-3-methylpyrazol-4-yl)ethyl]-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]azanium Traditional Name: [(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-(4-hydroxy-3,5-dimethoxy-benzyl)ammonium Formula: C17H26N3O3+ MolecularWeight: 320.40664

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C(C)[NH2+]CC2=CC(=C(C(=C2)OC)O)OC

Isomeric SMILES

CCN1C=C(C(=N1)C)[C@H](C)[NH2+]CC2=CC(=C(C(=C2)OC)O)OC

InChI

InChI=1S/C17H25N3O3/c1-6-20-10-14(12(3)19-20)11(2)18-9-13-7-15(22-4)17(21)16(8-13)23-5/h7-8,10-11,18,21H,6,9H2,1-5H3/p+1/t11-/m0/s1