carbanide; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; nickel; triphenylphosphanium

Systemtic Name: carbanide; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; nickel; triphenylphosphanium Openeye Name: carbanide; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; nickel; triphenylphosphonium CAS Name: carbanide; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; nickel; triphenylphosphonium IUPAC Name: carbanide; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; nickel; triphenylphosphanium Traditional Name: carbanide; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; nickel; triphenylphosphonium Formula: C53H54Ni2O2P2 MolecularWeight: 902.328982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Ni].[Ni]

Isomeric SMILES

[CH3-].[CH3-].CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Ni].[Ni]

InChI

InChI=1S/2C18H15P.C15H16O2.2CH3.2Ni/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;;;;/h2*1-15H;3-10,16-17H,1-2H3;2*1H3;;/q;;;2*-1;;/p+2