bis(chloranyl)zirconium; (Z)-3-(cyclohexylmethylamino)-1-phenyl-but-2-en-1-one

Systemtic Name: bis(chloranyl)zirconium; (Z)-3-(cyclohexylmethylamino)-1-phenyl-but-2-en-1-one Openeye Name: (Z)-3-(cyclohexylmethylamino)-1-phenyl-but-2-en-1-one; dichlorozirconium CAS Name: (Z)-3-(cyclohexylmethylamino)-1-phenyl-2-buten-1-one; dichlorozirconium IUPAC Name: (Z)-3-(cyclohexylmethylamino)-1-phenylbut-2-en-1-one; dichlorozirconium Traditional Name: (Z)-3-(cyclohexylmethylamino)-1-phenyl-but-2-en-1-one; dichlorozirconium Formula: C17H23Cl2NOZr MolecularWeight: 419.50062

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=CC=CC=C1)NCC2CCCCC2.Cl[Zr]Cl

Isomeric SMILES

C/C(=C/C(=O)C1=CC=CC=C1)/NCC2CCCCC2.Cl[Zr]Cl

InChI

InChI=1S/C17H23NO.2ClH.Zr/c1-14(18-13-15-8-4-2-5-9-15)12-17(19)16-10-6-3-7-11-16;;;/h3,6-7,10-12,15,18H,2,4-5,8-9,13H2,1H3;2*1H;/q;;;+2/p-2/b14-12-;;;