1-(2,4-dinitrophenyl)-3-(phenylmethyl)pyridin-1-ium

Systemtic Name: 1-(2,4-dinitrophenyl)-3-(phenylmethyl)pyridin-1-ium Openeye Name: 3-benzyl-1-(2,4-dinitrophenyl)pyridin-1-ium CAS Name: 1-(2,4-dinitrophenyl)-3-(phenylmethyl)pyridin-1-ium IUPAC Name: 3-benzyl-1-(2,4-dinitrophenyl)pyridin-1-ium Traditional Name: 3-benzyl-1-(2,4-dinitrophenyl)pyridin-1-ium Formula: C18H14N3O4+ MolecularWeight: 336.32146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C[N+](=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=C[N+](=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H14N3O4/c22-20(23)16-8-9-17(18(12-16)21(24)25)19-10-4-7-15(13-19)11-14-5-2-1-3-6-14/h1-10,12-13H,11H2/q+1