3-[1-(2,4-dinitrophenyl)pyridin-1-ium-3-yl]propan-1-ol

Systemtic Name: 3-[1-(2,4-dinitrophenyl)pyridin-1-ium-3-yl]propan-1-ol Openeye Name: 3-[1-(2,4-dinitrophenyl)pyridin-1-ium-3-yl]propan-1-ol CAS Name: 3-[1-(2,4-dinitrophenyl)-3-pyridin-1-iumyl]-1-propanol IUPAC Name: 3-[1-(2,4-dinitrophenyl)pyridin-1-ium-3-yl]propan-1-ol Traditional Name: 3-[1-(2,4-dinitrophenyl)pyridin-1-ium-3-yl]propan-1-ol Formula: C14H14N3O5+ MolecularWeight: 304.27806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N3O5/c18-8-2-4-11-3-1-7-15(10-11)13-6-5-12(16(19)20)9-14(13)17(21)22/h1,3,5-7,9-10,18H,2,4,8H2/q+1