copper (2-methylphenyl)-[(Z)-3-(2-methylphenyl)imino-2-(4-nitrophenyl)prop-1-enyl]azanide

Systemtic Name: copper (2-methylphenyl)-[(Z)-3-(2-methylphenyl)imino-2-(4-nitrophenyl)prop-1-enyl]azanide Openeye Name: copper [(Z)-2-(4-nitrophenyl)-3-(o-tolylimino)prop-1-enyl]-(o-tolyl)azanide CAS Name: copper (2-methylphenyl)-[(Z)-3-(2-methylphenyl)imino-2-(4-nitrophenyl)prop-1-enyl]azanide IUPAC Name: copper (2-methylphenyl)-[(Z)-3-(2-methylphenyl)imino-2-(4-nitrophenyl)prop-1-enyl]azanide Traditional Name: cupric [(Z)-2-(4-nitrophenyl)-3-(o-tolylimino)prop-1-enyl]-(o-tolyl)azanide Formula: C46H40CuN6O4 MolecularWeight: 804.3936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1[N-]C=C(C=NC2=CC=CC=C2C)C3=CC=C(C=C3)[N+](=O)[O-].CC1=CC=CC=C1[N-]C=C(C=NC2=CC=CC=C2C)C3=CC=C(C=C3)[N+](=O)[O-].[Cu+2]

Isomeric SMILES

CC1=CC=CC=C1[N-]/C=C(/C2=CC=C(C=C2)[N+](=O)[O-])\C=NC3=CC=CC=C3C.CC1=CC=CC=C1[N-]/C=C(/C2=CC=C(C=C2)[N+](=O)[O-])\C=NC3=CC=CC=C3C.[Cu+2]

InChI

InChI=1S/2C23H20N3O2.Cu/c2*1-17-7-3-5-9-22(17)24-15-20(16-25-23-10-6-4-8-18(23)2)19-11-13-21(14-12-19)26(27)28;/h2*3-16H,1-2H3;/q2*-1;+2/b2*20-15+,25-16?;