[2,6-di(propan-2-yl)phenyl]-(1-phenyl-2-pyridin-2-yl-propan-2-yl)azanide; methanidylbenzene; zirconium

Systemtic Name: [2,6-di(propan-2-yl)phenyl]-(1-phenyl-2-pyridin-2-yl-propan-2-yl)azanide; methanidylbenzene; zirconium Openeye Name: (2,6-diisopropylphenyl)-[1-methyl-2-phenyl-1-(2-pyridyl)ethyl]azanide; methanidylbenzene; zirconium CAS Name: [2,6-di(propan-2-yl)phenyl]-[1-phenyl-2-(2-pyridinyl)propan-2-yl]azanide; methanidylbenzene; zirconium IUPAC Name: [2,6-di(propan-2-yl)phenyl]-(1-phenyl-2-pyridin-2-ylpropan-2-yl)azanide; methanidylbenzene; zirconium Traditional Name: (2,6-diisopropylphenyl)-[1-methyl-2-phenyl-1-(2-pyridyl)ethyl]azanide; methanidylbenzene; zirconium Formula: C47H52N2Zr-4 MolecularWeight: 736.15318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)[N-]C(C)(CC2=CC=CC=C2)C3=CC=CC=N3.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Zr]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)[N-]C(C)(CC2=CC=CC=C2)C3=CC=CC=N3.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Zr]

InChI

InChI=1S/C26H31N2.3C7H7.Zr/c1-19(2)22-14-11-15-23(20(3)4)25(22)28-26(5,24-16-9-10-17-27-24)18-21-12-7-6-8-13-21;3*1-7-5-3-2-4-6-7;/h6-17,19-20H,18H2,1-5H3;3*2-6H,1H2;/q4*-1;