1-phenyl-2-[3-[2-phenyl-5-(phenylmethyl)pyrazol-3-yl]pyridin-1-ium-1-yl]ethanone

Systemtic Name: 1-phenyl-2-[3-[2-phenyl-5-(phenylmethyl)pyrazol-3-yl]pyridin-1-ium-1-yl]ethanone Openeye Name: 2-[3-(5-benzyl-2-phenyl-pyrazol-3-yl)pyridin-1-ium-1-yl]-1-phenyl-ethanone CAS Name: 1-phenyl-2-[3-[2-phenyl-5-(phenylmethyl)-3-pyrazolyl]-1-pyridin-1-iumyl]ethanone IUPAC Name: 2-[3-(5-benzyl-2-phenylpyrazol-3-yl)pyridin-1-ium-1-yl]-1-phenylethanone Traditional Name: 2-[3-(5-benzyl-2-phenyl-pyrazol-3-yl)pyridin-1-ium-1-yl]-1-phenyl-ethanone Formula: C29H24N3O+ MolecularWeight: 430.52036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN(C(=C2)C3=C[N+](=CC=C3)CC(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN(C(=C2)C3=C[N+](=CC=C3)CC(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H24N3O/c33-29(24-13-6-2-7-14-24)22-31-18-10-15-25(21-31)28-20-26(19-23-11-4-1-5-12-23)30-32(28)27-16-8-3-9-17-27/h1-18,20-21H,19,22H2/q+1