2-tert-butyl-4-methyl-6-[(3,4,5-trimethoxyphenyl)methylideneamino]phenol; dimethylazanide; zirconium(2+)

Systemtic Name: 2-tert-butyl-4-methyl-6-[(3,4,5-trimethoxyphenyl)methylideneamino]phenol; dimethylazanide; zirconium(2+) Openeye Name: 2-tert-butyl-4-methyl-6-[(3,4,5-trimethoxyphenyl)methyleneamino]phenol; dimethylazanide; zirconium(2+) CAS Name: 2-tert-butyl-4-methyl-6-[(3,4,5-trimethoxyphenyl)methylideneamino]phenol; dimethylazanide; zirconium(2+) IUPAC Name: 2-tert-butyl-4-methyl-6-[(3,4,5-trimethoxyphenyl)methylideneamino]phenol; dimethylazanide; zirconium(2+) Traditional Name: 2-tert-butyl-4-methyl-6-[(3,4,5-trimethoxybenzylidene)amino]phenol; dimethylazanide; zirconium(2+) Formula: C25H39N3O4Zr MolecularWeight: 536.81886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)N=CC2=CC(=C(C(=C2)OC)OC)OC)O)C(C)(C)C.C[N-]C.C[N-]C.[Zr+2]

Isomeric SMILES

CC1=CC(=C(C(=C1)N=CC2=CC(=C(C(=C2)OC)OC)OC)O)C(C)(C)C.C[N-]C.C[N-]C.[Zr+2]

InChI

InChI=1S/C21H27NO4.2C2H6N.Zr/c1-13-8-15(21(2,3)4)19(23)16(9-13)22-12-14-10-17(24-5)20(26-7)18(11-14)25-6;2*1-3-2;/h8-12,23H,1-7H3;2*1-2H3;/q;2*-1;+2