chromium(2+); (4Z)-4-[(3,5-dinitro-2-oxidanyl-phenyl)hydrazinylidene]-3-oxidanylidene-N-phenyl-naphthalene-2-carboxamide

Systemtic Name: chromium(2+); (4Z)-4-[(3,5-dinitro-2-oxidanyl-phenyl)hydrazinylidene]-3-oxidanylidene-N-phenyl-naphthalene-2-carboxamide Openeye Name: chromous (4Z)-4-[(2-hydroxy-3,5-dinitro-phenyl)hydrazono]-3-oxo-N-phenyl-naphthalene-2-carboxamide CAS Name: chromium(2+); (4Z)-4-[(2-hydroxy-3,5-dinitrophenyl)hydrazinylidene]-3-oxo-N-phenyl-2-naphthalenecarboxamide IUPAC Name: chromium(2+); (4Z)-4-[(2-hydroxy-3,5-dinitrophenyl)hydrazinylidene]-3-oxo-N-phenylnaphthalene-2-carboxamide Traditional Name: chromous (4Z)-4-[(2-hydroxy-3,5-dinitro-phenyl)hydrazono]-3-keto-N-phenyl-2-naphthamide Formula: C46H30CrN10O14+2 MolecularWeight: 998.7851

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=NNC4=CC(=CC(=C4O)[N+](=O)[O-])[N+](=O)[O-])C2=O.C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=NNC4=CC(=CC(=C4O)[N+](=O)[O-])[N+](=O)[O-])C2=O.[Cr+2]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC(=CC(=C4O)[N+](=O)[O-])[N+](=O)[O-])/C2=O.C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC(=CC(=C4O)[N+](=O)[O-])[N+](=O)[O-])/C2=O.[Cr+2]

InChI

InChI=1S/2C23H15N5O7.Cr/c2*29-21-17(23(31)24-14-7-2-1-3-8-14)10-13-6-4-5-9-16(13)20(21)26-25-18-11-15(27(32)33)12-19(22(18)30)28(34)35;/h2*1-12,25,30H,(H,24,31);/q;;+2/b2*26-20-;