(5-hexoxy-3-methyl-1-phenyl-pyrazol-4-yl)methylazanium

Systemtic Name: (5-hexoxy-3-methyl-1-phenyl-pyrazol-4-yl)methylazanium Openeye Name: (5-hexoxy-3-methyl-1-phenyl-pyrazol-4-yl)methylammonium CAS Name: (5-hexoxy-3-methyl-1-phenyl-4-pyrazolyl)methylammonium IUPAC Name: (5-hexoxy-3-methyl-1-phenylpyrazol-4-yl)methylazanium Traditional Name: (5-hexoxy-3-methyl-1-phenyl-pyrazol-4-yl)methylammonium Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C(=NN1C2=CC=CC=C2)C)C[NH3+]

Isomeric SMILES

CCCCCCOC1=C(C(=NN1C2=CC=CC=C2)C)C[NH3+]

InChI

InChI=1S/C17H25N3O/c1-3-4-5-9-12-21-17-16(13-18)14(2)19-20(17)15-10-7-6-8-11-15/h6-8,10-11H,3-5,9,12-13,18H2,1-2H3/p+1