[4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: [4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-[4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-isopropyl-ammonium CAS Name: [4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-propan-2-ylazanium Traditional Name: benzyl-[4-(chloromethyl)-2,5-dimethyl-3-pyrazolin-3-ylidene]-isopropyl-ammonium Formula: C16H23ClN3+ MolecularWeight: 292.82692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[N+](CC2=CC=CC=C2)C(C)C)N(N1)C)CCl

Isomeric SMILES

CC1=C(C(=[N+](CC2=CC=CC=C2)C(C)C)N(N1)C)CCl

InChI

InChI=1S/C16H22ClN3/c1-12(2)20(11-14-8-6-5-7-9-14)16-15(10-17)13(3)18-19(16)4/h5-9,12H,10-11H2,1-4H3/p+1