2-[2-(3-methoxy-4-nitro-phenyl)pyridin-1-ium-1-yl]ethanal

Systemtic Name: 2-[2-(3-methoxy-4-nitro-phenyl)pyridin-1-ium-1-yl]ethanal Openeye Name: 2-[2-(3-methoxy-4-nitro-phenyl)pyridin-1-ium-1-yl]acetaldehyde CAS Name: 2-[2-(3-methoxy-4-nitrophenyl)-1-pyridin-1-iumyl]acetaldehyde IUPAC Name: 2-[2-(3-methoxy-4-nitrophenyl)pyridin-1-ium-1-yl]acetaldehyde Traditional Name: 2-[2-(3-methoxy-4-nitro-phenyl)pyridin-1-ium-1-yl]acetaldehyde Formula: C14H13N2O4+ MolecularWeight: 273.26402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC=CC=[N+]2CC=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC=CC=[N+]2CC=O)[N+](=O)[O-]

InChI

InChI=1S/C14H13N2O4/c1-20-14-10-11(5-6-13(14)16(18)19)12-4-2-3-7-15(12)8-9-17/h2-7,9-10H,8H2,1H3/q+1