[4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [4-(chloromethyl)-2,5-dimethyl-3-pyrazolin-3-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C13H25ClN4+2 MolecularWeight: 272.8174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[N+](C)C2CC[NH+](CC2)C)N(N1)C)CCl

Isomeric SMILES

CC1=C(C(=[N+](C)C2CC[NH+](CC2)C)N(N1)C)CCl

InChI

InChI=1S/C13H23ClN4/c1-10-12(9-14)13(18(4)15-10)17(3)11-5-7-16(2)8-6-11/h11H,5-9H2,1-4H3/p+2