cobalt; 5-methyl-4-[(2Z)-2-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-2-phenyl-1H-pyrazol-3-one

Systemtic Name: cobalt; 5-methyl-4-[(2Z)-2-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-2-phenyl-1H-pyrazol-3-one Openeye Name: cobalt; 5-methyl-4-[(2Z)-2-(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)hydrazino]-2-phenyl-1H-pyrazol-3-one CAS Name: cobalt; 5-methyl-4-[(2Z)-2-(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)hydrazinyl]-2-phenyl-1H-pyrazol-3-one IUPAC Name: cobalt; 5-methyl-4-[(2Z)-2-(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinyl]-2-phenyl-1H-pyrazol-3-one Traditional Name: cobalt; 4-[(N'Z)-N'-(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)hydrazino]-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C32H26CoN10O8 MolecularWeight: 737.54424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)NN=C3C=C(C=CC3=O)[N+](=O)[O-].CC1=C(C(=O)N(N1)C2=CC=CC=C2)NN=C3C=C(C=CC3=O)[N+](=O)[O-].[Co]

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)N/N=C/3\C(=O)C=CC(=C3)[N+](=O)[O-].CC1=C(C(=O)N(N1)C2=CC=CC=C2)N/N=C/3\C(=O)C=CC(=C3)[N+](=O)[O-].[Co]

InChI

InChI=1S/2C16H13N5O4.Co/c2*1-10-15(16(23)20(19-10)11-5-3-2-4-6-11)18-17-13-9-12(21(24)25)7-8-14(13)22;/h2*2-9,18-19H,1H3;/b2*17-13-;