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

Systemtic Name: bis(chloranyl)zirconium; (6Z)-2-tert-butyl-6-[(naphthalen-1-ylamino)methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-2-tert-butyl-6-[(1-naphthylamino)methylene]cyclohexa-2,4-dien-1-one; dichlorozirconium CAS Name: (6Z)-2-tert-butyl-6-[(1-naphthalenylamino)methylidene]-1-cyclohexa-2,4-dienone; dichlorozirconium IUPAC Name: (6Z)-2-tert-butyl-6-[(naphthalen-1-ylamino)methylidene]cyclohexa-2,4-dien-1-one; dichlorozirconium Traditional Name: (6Z)-2-tert-butyl-6-[(1-naphthylamino)methylene]cyclohexa-2,4-dien-1-one; dichlorozirconium Formula: C21H21Cl2NOZr MolecularWeight: 465.52754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC(=CNC2=CC=CC3=CC=CC=C32)C1=O.Cl[Zr]Cl

Isomeric SMILES

CC(C)(C)C1=CC=C/C(=C/NC2=CC=CC3=CC=CC=C32)/C1=O.Cl[Zr]Cl

InChI

InChI=1S/C21H21NO.2ClH.Zr/c1-21(2,3)18-12-6-10-16(20(18)23)14-22-19-13-7-9-15-8-4-5-11-17(15)19;;;/h4-14,22H,1-3H3;2*1H;/q;;;+2/p-2/b16-14-;;;