[(S)-(3,4-diethoxyphenyl)-(1-methylpyrazol-4-yl)methyl]azanium

Systemtic Name: [(S)-(3,4-diethoxyphenyl)-(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: [(S)-(3,4-diethoxyphenyl)-(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: [(S)-(3,4-diethoxyphenyl)-(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [(S)-(3,4-diethoxyphenyl)-(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: [(S)-(3,4-diethoxyphenyl)-(1-methylpyrazol-4-yl)methyl]ammonium Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CN(N=C2)C)[NH3+])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@@H](C2=CN(N=C2)C)[NH3+])OCC

InChI

InChI=1S/C15H21N3O2/c1-4-19-13-7-6-11(8-14(13)20-5-2)15(16)12-9-17-18(3)10-12/h6-10,15H,4-5,16H2,1-3H3/p+1/t15-/m0/s1