2-[1-(4-nitrophenyl)ethylsulfonyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-[1-(4-nitrophenyl)ethylsulfonyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 2-[1-(4-nitrophenyl)ethylsulfonyl]-1-oxido-pyridin-1-ium CAS Name: 2-[1-(4-nitrophenyl)ethylsulfonyl]-1-oxidopyridin-1-ium IUPAC Name: 2-[1-(4-nitrophenyl)ethylsulfonyl]-1-oxidopyridin-1-ium Traditional Name: 2-[1-(4-nitrophenyl)ethylsulfonyl]-1-oxido-pyridin-1-ium Formula: C13H12N2O5S MolecularWeight: 308.30978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O5S/c1-10(11-5-7-12(8-6-11)15(17)18)21(19,20)13-4-2-3-9-14(13)16/h2-10H,1H3