2,5,8,11-tetraphenyl-1,4,7-triaza-10-azanidacyclododecane; titanium(2+)

Systemtic Name: 2,5,8,11-tetraphenyl-1,4,7-triaza-10-azanidacyclododecane; titanium(2+) Openeye Name: 2,5,8,11-tetraphenyl-1,4,7-triaza-10-azanidacyclododecane; titanium(2+) CAS Name: 2,5,8,11-tetraphenyl-1,4,7-triaza-10-azanidacyclododecane; titanium(2+) IUPAC Name: 2,5,8,11-tetraphenyl-1,4,7-triaza-10-azanidacyclododecane; titanium(2+) Traditional Name: 2,5,8,11-tetraphenyl-1,4,7-triaza-10-azanidacyclododecane; titanium(2+) Formula: C32H35N4Ti+ MolecularWeight: 523.5141

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC([N-]CC(NCC(N1)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Ti+2]

Isomeric SMILES

C1C(NCC([N-]CC(NCC(N1)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Ti+2]

InChI

InChI=1S/C32H35N4.Ti/c1-5-13-25(14-6-1)29-21-34-31(27-17-9-3-10-18-27)23-36-32(28-19-11-4-12-20-28)24-35-30(22-33-29)26-15-7-2-8-16-26;/h1-20,29-35H,21-24H2;/q-1;+2