4-chloranyl-2-methyl-N-(phenylmethyl)-N-pyridin-2-yl-1H-pyrazol-2-ium-5-carboxamide

Systemtic Name: 4-chloranyl-2-methyl-N-(phenylmethyl)-N-pyridin-2-yl-1H-pyrazol-2-ium-5-carboxamide Openeye Name: N-benzyl-4-chloro-2-methyl-N-(2-pyridyl)-1H-pyrazol-2-ium-5-carboxamide CAS Name: 4-chloro-2-methyl-N-(phenylmethyl)-N-(2-pyridinyl)-1H-pyrazol-2-ium-5-carboxamide IUPAC Name: N-benzyl-4-chloro-2-methyl-N-pyridin-2-yl-1H-pyrazol-2-ium-5-carboxamide Traditional Name: N-benzyl-4-chloro-2-methyl-N-(2-pyridyl)-1H-pyrazol-2-ium-5-carboxamide Formula: C17H16ClN4O+ MolecularWeight: 327.78814

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC(=C(N1)C(=O)N(CC2=CC=CC=C2)C3=CC=CC=N3)Cl

Isomeric SMILES

C[N+]1=CC(=C(N1)C(=O)N(CC2=CC=CC=C2)C3=CC=CC=N3)Cl

InChI

InChI=1S/C17H15ClN4O/c1-21-12-14(18)16(20-21)17(23)22(15-9-5-6-10-19-15)11-13-7-3-2-4-8-13/h2-10,12H,11H2,1H3/p+1