4-chloranyl-3-ethyl-1-methyl-N-[[2,3,5,6-tetrakis(fluoranyl)-4-(2-methylpropoxy)phenyl]methyl]pyrazol-1-ium-1-carboxamide

Systemtic Name: 4-chloranyl-3-ethyl-1-methyl-N-[[2,3,5,6-tetrakis(fluoranyl)-4-(2-methylpropoxy)phenyl]methyl]pyrazol-1-ium-1-carboxamide Openeye Name: 4-chloro-3-ethyl-1-methyl-N-[(2,3,5,6-tetrafluoro-4-isobutoxy-phenyl)methyl]pyrazol-1-ium-1-carboxamide CAS Name: 4-chloro-3-ethyl-1-methyl-N-[[2,3,5,6-tetrafluoro-4-(2-methylpropoxy)phenyl]methyl]-1-pyrazol-1-iumcarboxamide IUPAC Name: 4-chloro-3-ethyl-1-methyl-N-[[2,3,5,6-tetrafluoro-4-(2-methylpropoxy)phenyl]methyl]pyrazol-1-ium-1-carboxamide Traditional Name: 4-chloro-3-ethyl-1-methyl-N-(2,3,5,6-tetrafluoro-4-isobutoxy-benzyl)pyrazol-1-ium-1-carboxamide Formula: C18H21ClF4N3O2+ MolecularWeight: 422.824853

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=N[N+](C=C1Cl)(C)C(=O)NCC2=C(C(=C(C(=C2F)F)OCC(C)C)F)F

Isomeric SMILES

CCC1=N[N+](C=C1Cl)(C)C(=O)NCC2=C(C(=C(C(=C2F)F)OCC(C)C)F)F

InChI

InChI=1S/C18H20ClF4N3O2/c1-5-12-11(19)7-26(4,25-12)18(27)24-6-10-13(20)15(22)17(16(23)14(10)21)28-8-9(2)3/h7,9H,5-6,8H2,1-4H3/p+1