N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-N-methyl-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-N-methyl-1-oxido-pyridin-1-ium-3-carboxamide Formula: C14H12ClN3O4 MolecularWeight: 321.71578

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)C2=C[N+](=CC=C2)[O-]

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)C2=C[N+](=CC=C2)[O-]

InChI

InChI=1S/C14H12ClN3O4/c1-16(14(19)10-3-2-6-17(20)9-10)8-11-7-12(18(21)22)4-5-13(11)15/h2-7,9H,8H2,1H3