1-(2-oxidanidyl-6-phenyl-naphthalen-1-yl)-6-phenyl-naphthalen-2-olate; oxygen(2-); propan-2-olate; titanium(4+)

Systemtic Name: 1-(2-oxidanidyl-6-phenyl-naphthalen-1-yl)-6-phenyl-naphthalen-2-olate; oxygen(2-); propan-2-olate; titanium(4+) Openeye Name: 1-(2-oxido-6-phenyl-1-naphthyl)-6-phenyl-naphthalen-2-olate; oxygen(2-); propan-2-olate; titanium(4+) CAS Name: 1-(2-oxido-6-phenyl-1-naphthalenyl)-6-phenyl-2-naphthalenolate; oxygen(2-); 2-propanolate; titanium(4+) IUPAC Name: 1-(2-oxido-6-phenylnaphthalen-1-yl)-6-phenylnaphthalen-2-olate; oxygen(2-); propan-2-olate; titanium(4+) Traditional Name: 1-(2-oxido-6-phenyl-1-naphthyl)-6-phenyl-naphthalen-2-olate; oxygen(2-); propan-2-olate; titanium(4+) Formula: C70H54O7Ti2 MolecularWeight: 1102.90756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[O-].CC(C)[O-].C1=CC=C(C=C1)C2=CC3=C(C=C2)C(=C(C=C3)[O-])C4=C(C=CC5=C4C=CC(=C5)C6=CC=CC=C6)[O-].C1=CC=C(C=C1)C2=CC3=C(C=C2)C(=C(C=C3)[O-])C4=C(C=CC5=C4C=CC(=C5)C6=CC=CC=C6)[O-].[O-2].[Ti+4].[Ti+4]

Isomeric SMILES

CC(C)[O-].CC(C)[O-].C1=CC=C(C=C1)C2=CC3=C(C=C2)C(=C(C=C3)[O-])C4=C(C=CC5=C4C=CC(=C5)C6=CC=CC=C6)[O-].C1=CC=C(C=C1)C2=CC3=C(C=C2)C(=C(C=C3)[O-])C4=C(C=CC5=C4C=CC(=C5)C6=CC=CC=C6)[O-].[O-2].[Ti+4].[Ti+4]

InChI

InChI=1S/2C32H22O2.2C3H7O.O.2Ti/c2*33-29-17-13-25-19-23(21-7-3-1-4-8-21)11-15-27(25)31(29)32-28-16-12-24(22-9-5-2-6-10-22)20-26(28)14-18-30(32)34;2*1-3(2)4;;;/h2*1-20,33-34H;2*3H,1-2H3;;;/q;;2*-1;-2;2*+4/p-4