3-chloranyl-6-methyl-5-(4-nitrophenyl)-1-oxidanidyl-N-phenyl-pyridazin-1-ium-4-carboxamide

Systemtic Name: 3-chloranyl-6-methyl-5-(4-nitrophenyl)-1-oxidanidyl-N-phenyl-pyridazin-1-ium-4-carboxamide Openeye Name: 3-chloro-6-methyl-5-(4-nitrophenyl)-1-oxido-N-phenyl-pyridazin-1-ium-4-carboxamide CAS Name: 3-chloro-6-methyl-5-(4-nitrophenyl)-1-oxido-N-phenyl-4-pyridazin-1-iumcarboxamide IUPAC Name: 3-chloro-6-methyl-5-(4-nitrophenyl)-1-oxido-N-phenylpyridazin-1-ium-4-carboxamide Traditional Name: 3-chloro-6-methyl-5-(4-nitrophenyl)-1-oxido-N-phenyl-pyridazin-1-ium-4-carboxamide Formula: C18H13ClN4O4 MolecularWeight: 384.77322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](N=C(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3)Cl)[O-]

Isomeric SMILES

CC1=[N+](N=C(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3)Cl)[O-]

InChI

InChI=1S/C18H13ClN4O4/c1-11-15(12-7-9-14(10-8-12)23(26)27)16(17(19)21-22(11)25)18(24)20-13-5-3-2-4-6-13/h2-10H,1H3,(H,20,24)