(4Z)-4-[(4-chloranyl-5-nitro-2-oxidanyl-phenyl)hydrazinylidene]-N-(2-methylphenyl)-3-oxidanylidene-naphthalene-2-carboxamide; iron

Systemtic Name: (4Z)-4-[(4-chloranyl-5-nitro-2-oxidanyl-phenyl)hydrazinylidene]-N-(2-methylphenyl)-3-oxidanylidene-naphthalene-2-carboxamide; iron Openeye Name: (4Z)-4-[(4-chloro-2-hydroxy-5-nitro-phenyl)hydrazono]-N-(o-tolyl)-3-oxo-naphthalene-2-carboxamide; iron CAS Name: (4Z)-4-[(4-chloro-2-hydroxy-5-nitrophenyl)hydrazinylidene]-N-(2-methylphenyl)-3-oxo-2-naphthalenecarboxamide; iron IUPAC Name: (4Z)-4-[(4-chloro-2-hydroxy-5-nitrophenyl)hydrazinylidene]-N-(2-methylphenyl)-3-oxonaphthalene-2-carboxamide; iron Traditional Name: (4Z)-4-[(4-chloro-2-hydroxy-5-nitro-phenyl)hydrazono]-3-keto-N-(o-tolyl)-2-naphthamide; iron Formula: C48H34Cl2FeN8O10 MolecularWeight: 1009.58216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=NNC4=CC(=C(C=C4O)Cl)[N+](=O)[O-])C2=O.CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=NNC4=CC(=C(C=C4O)Cl)[N+](=O)[O-])C2=O.[Fe]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC(=C(C=C4O)Cl)[N+](=O)[O-])/C2=O.CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC(=C(C=C4O)Cl)[N+](=O)[O-])/C2=O.[Fe]

InChI

InChI=1S/2C24H17ClN4O5.Fe/c2*1-13-6-2-5-9-18(13)26-24(32)16-10-14-7-3-4-8-15(14)22(23(16)31)28-27-19-12-20(29(33)34)17(25)11-21(19)30;/h2*2-12,27,30H,1H3,(H,26,32);/b2*28-22-;