bis(chloranyl)zirconium; (6Z)-2-tert-butyl-6-[(cyclohexylamino)-phenyl-methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: bis(chloranyl)zirconium; (6Z)-2-tert-butyl-6-[(cyclohexylamino)-phenyl-methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-2-tert-butyl-6-[(cyclohexylamino)-phenyl-methylene]cyclohexa-2,4-dien-1-one; dichlorozirconium CAS Name: (6Z)-2-tert-butyl-6-[(cyclohexylamino)-phenylmethylidene]-1-cyclohexa-2,4-dienone; dichlorozirconium IUPAC Name: (6Z)-2-tert-butyl-6-[(cyclohexylamino)-phenylmethylidene]cyclohexa-2,4-dien-1-one; dichlorozirconium Traditional Name: (6Z)-2-tert-butyl-6-[(cyclohexylamino)-phenyl-methylene]cyclohexa-2,4-dien-1-one; dichlorozirconium Formula: C23H29Cl2NOZr MolecularWeight: 497.61246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC(=C(C2=CC=CC=C2)NC3CCCCC3)C1=O.Cl[Zr]Cl

Isomeric SMILES

CC(C)(C)C1=CC=C/C(=C(\C2=CC=CC=C2)/NC3CCCCC3)/C1=O.Cl[Zr]Cl

InChI

InChI=1S/C23H29NO.2ClH.Zr/c1-23(2,3)20-16-10-15-19(22(20)25)21(17-11-6-4-7-12-17)24-18-13-8-5-9-14-18;;;/h4,6-7,10-12,15-16,18,24H,5,8-9,13-14H2,1-3H3;2*1H;/q;;;+2/p-2/b21-19-;;;