3-(2,4-dinitrophenoxy)-1-prop-2-enyl-pyridin-1-ium

Systemtic Name: 3-(2,4-dinitrophenoxy)-1-prop-2-enyl-pyridin-1-ium Openeye Name: 1-allyl-3-(2,4-dinitrophenoxy)pyridin-1-ium CAS Name: 3-(2,4-dinitrophenoxy)-1-prop-2-enylpyridin-1-ium IUPAC Name: 3-(2,4-dinitrophenoxy)-1-prop-2-enylpyridin-1-ium Traditional Name: 1-allyl-3-(2,4-dinitrophenoxy)pyridin-1-ium Formula: C14H12N3O5+ MolecularWeight: 302.26218

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=CC=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C=CC[N+]1=CC=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H12N3O5/c1-2-7-15-8-3-4-12(10-15)22-14-6-5-11(16(18)19)9-13(14)17(20)21/h2-6,8-10H,1,7H2/q+1