2,6,10,14-tetraphenyl-1,5,9-triaza-13-azanidacyclohexadecane; titanium(2+)

Systemtic Name: 2,6,10,14-tetraphenyl-1,5,9-triaza-13-azanidacyclohexadecane; titanium(2+) Openeye Name: 2,6,10,14-tetraphenyl-1,5,9-triaza-13-azanidacyclohexadecane; titanium(2+) CAS Name: 2,6,10,14-tetraphenyl-1,5,9-triaza-13-azanidacyclohexadecane; titanium(2+) IUPAC Name: 2,6,10,14-tetraphenyl-1,5,9-triaza-13-azanidacyclohexadecane; titanium(2+) Traditional Name: 2,6,10,14-tetraphenyl-1,5,9-triaza-13-azanidacyclohexadecane; titanium(2+) Formula: C36H43N4Ti+ MolecularWeight: 579.62042

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(CCNC(CC[N-]C(CCNC1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Ti+2]

Isomeric SMILES

C1CNC(CCNC(CC[N-]C(CCNC1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Ti+2]

InChI

InChI=1S/C36H43N4.Ti/c1-5-13-29(14-6-1)33-21-25-38-35(31-17-9-3-10-18-31)23-27-40-36(32-19-11-4-12-20-32)24-28-39-34(22-26-37-33)30-15-7-2-8-16-30;/h1-20,33-39H,21-28H2;/q-1;+2