3-methyl-1-(2-nitrophenyl)-1-oxidanidyl-piperidin-1-ium

Systemtic Name: 3-methyl-1-(2-nitrophenyl)-1-oxidanidyl-piperidin-1-ium Openeye Name: 3-methyl-1-(2-nitrophenyl)-1-oxido-piperidin-1-ium CAS Name: 3-methyl-1-(2-nitrophenyl)-1-oxidopiperidin-1-ium IUPAC Name: 3-methyl-1-(2-nitrophenyl)-1-oxidopiperidin-1-ium Traditional Name: 3-methyl-1-(2-nitrophenyl)-1-oxido-piperidin-1-ium Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[N+](C1)(C2=CC=CC=C2[N+](=O)[O-])[O-]

Isomeric SMILES

CC1CCC[N+](C1)(C2=CC=CC=C2[N+](=O)[O-])[O-]

InChI

InChI=1S/C12H16N2O3/c1-10-5-4-8-14(17,9-10)12-7-3-2-6-11(12)13(15)16/h2-3,6-7,10H,4-5,8-9H2,1H3