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

Systemtic Name: 3-chloranyl-6-methyl-N-(3-nitrophenyl)-1-oxidanidyl-5-phenyl-pyridazin-1-ium-4-carboxamide Openeye Name: 3-chloro-6-methyl-N-(3-nitrophenyl)-1-oxido-5-phenyl-pyridazin-1-ium-4-carboxamide CAS Name: 3-chloro-6-methyl-N-(3-nitrophenyl)-1-oxido-5-phenyl-4-pyridazin-1-iumcarboxamide IUPAC Name: 3-chloro-6-methyl-N-(3-nitrophenyl)-1-oxido-5-phenylpyridazin-1-ium-4-carboxamide Traditional Name: 3-chloro-6-methyl-N-(3-nitrophenyl)-1-oxido-5-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=CC=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])Cl)[O-]

Isomeric SMILES

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

InChI

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