[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-bis(prop-2-enyl)azanium

Systemtic Name: [4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-bis(prop-2-enyl)azanium Openeye Name: diallyl-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]ammonium CAS Name: [4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-bis(prop-2-enyl)ammonium IUPAC Name: [4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-bis(prop-2-enyl)azanium Traditional Name: diallyl-(2,5-dimethyl-4-methylol-3-pyrazolin-3-ylidene)ammonium Formula: C12H20N3O+ MolecularWeight: 222.3067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[N+](CC=C)CC=C)N(N1)C)CO

Isomeric SMILES

CC1=C(C(=[N+](CC=C)CC=C)N(N1)C)CO

InChI

InChI=1S/C12H19N3O/c1-5-7-15(8-6-2)12-11(9-16)10(3)13-14(12)4/h5-6,16H,1-2,7-9H2,3-4H3/p+1