oxidanium; bis(chloranyl)zirconium; 2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: oxidanium; bis(chloranyl)zirconium; 2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: oxonium; 2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylene]cyclohexa-2,4-dien-1-one; dichlorozirconium CAS Name: oxonium; 2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]ethylamino]methylidene]-1-cyclohexa-2,4-dienone; dichlorozirconium IUPAC Name: oxidanium; 2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one; dichlorozirconium Traditional Name: oxonium; 2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylene]cyclohexa-2,4-dien-1-one; dichlorozirconium Formula: C32H51Cl2N2O3Zr+ MolecularWeight: 673.88894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CNCCNC=C2C=C(C=C(C2=O)C(C)(C)C)C(C)(C)C)C(=O)C(=C1)C(C)(C)C.[OH3+].Cl[Zr]Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CNCCNC=C2C=C(C=C(C2=O)C(C)(C)C)C(C)(C)C)C(=O)C(=C1)C(C)(C)C.[OH3+].Cl[Zr]Cl

InChI

InChI=1S/C32H48N2O2.2ClH.H2O.Zr/c1-29(2,3)23-15-21(27(35)25(17-23)31(7,8)9)19-33-13-14-34-20-22-16-24(30(4,5)6)18-26(28(22)36)32(10,11)12;;;;/h15-20,33-34H,13-14H2,1-12H3;2*1H;1H2;/q;;;;+2/p-1