[4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-(2-cyanoethyl)-phenyl-azanium

Systemtic Name: [4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-(2-cyanoethyl)-phenyl-azanium Openeye Name: [4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-(2-cyanoethyl)-phenyl-ammonium CAS Name: [4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-(2-cyanoethyl)-phenylammonium IUPAC Name: [4-(chloromethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-(2-cyanoethyl)-phenylazanium Traditional Name: [4-(chloromethyl)-2,5-dimethyl-3-pyrazolin-3-ylidene]-(2-cyanoethyl)-phenyl-ammonium Formula: C15H18ClN4+ MolecularWeight: 289.78322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClN4/c1-12-14(11-16)15(19(2)18-12)20(10-6-9-17)13-7-4-3-5-8-13/h3-5,7-8H,6,10-11H2,1-2H3/p+1