gadolinium; 1,1,1,5,5,5-hexakis(fluoranyl)pentane-2,4-diol; nickel; 6-[[[2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]methylamino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: gadolinium; 1,1,1,5,5,5-hexakis(fluoranyl)pentane-2,4-diol; nickel; 6-[[[2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]methylamino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: gadolinium; 1,1,1,5,5,5-hexafluoropentane-2,4-diol; nickel; 6-[[[2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]methylamino]methylene]cyclohexa-2,4-dien-1-one CAS Name: gadolinium; 1,1,1,5,5,5-hexafluoropentane-2,4-diol; nickel; 6-[[[2-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]phenyl]methylamino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: gadolinium; 1,1,1,5,5,5-hexafluoropentane-2,4-diol; nickel; 6-[[[2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]methylamino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: gadolinium; 1,1,1,5,5,5-hexafluoropentane-2,4-diol; 6-[[[2-[(6-ketocyclohexa-2,4-dien-1-ylidene)methylamino]benzyl]amino]methylene]cyclohexa-2,4-dien-1-one; nickel Formula: C36H36F18GdN2NiO8 MolecularWeight: 1182.594298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC=C2C=CC=CC2=O)NC=C3C=CC=CC3=O.C(C(C(F)(F)F)O)C(C(F)(F)F)O.C(C(C(F)(F)F)O)C(C(F)(F)F)O.C(C(C(F)(F)F)O)C(C(F)(F)F)O.[Ni].[Gd]

Isomeric SMILES

C1=CC=C(C(=C1)CNC=C2C=CC=CC2=O)NC=C3C=CC=CC3=O.C(C(C(F)(F)F)O)C(C(F)(F)F)O.C(C(C(F)(F)F)O)C(C(F)(F)F)O.C(C(C(F)(F)F)O)C(C(F)(F)F)O.[Ni].[Gd]

InChI

InChI=1S/C21H18N2O2.3C5H6F6O2.Gd.Ni/c24-20-11-5-2-8-17(20)14-22-13-16-7-1-4-10-19(16)23-15-18-9-3-6-12-21(18)25;3*6-4(7,8)2(12)1-3(13)5(9,10)11;;/h1-12,14-15,22-23H,13H2;3*2-3,12-13H,1H2;;