2-[[5-chloranyl-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazol-1-ium-4-ylidene]methylamino]guanidine

Systemtic Name: 2-[[5-chloranyl-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazol-1-ium-4-ylidene]methylamino]guanidine Openeye Name: 2-[[5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazol-1-ium-4-ylidene]methylamino]guanidine CAS Name: 2-[[5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-4-pyrazol-1-iumylidene]methylamino]guanidine IUPAC Name: 2-[[5-chloro-1-[(4-fluorophenyl)methyl]-3-methylpyrazol-1-ium-4-ylidene]methylamino]guanidine Traditional Name: 2-[[5-chloro-1-(4-fluorobenzyl)-3-methyl-pyrazol-1-ium-4-ylidene]methylamino]guanidine Formula: C13H15ClFN6+ MolecularWeight: 309.749803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](=C(C1=CNN=C(N)N)Cl)CC2=CC=C(C=C2)F

Isomeric SMILES

CC1=N[N+](=C(C1=CNN=C(N)N)Cl)CC2=CC=C(C=C2)F

InChI

InChI=1S/C13H14ClFN6/c1-8-11(6-18-19-13(16)17)12(14)21(20-8)7-9-2-4-10(15)5-3-9/h2-6H,7H2,1H3,(H4,16,17,19)/p+1