2-phenyl-5,9,13-triaza-1-azanidacyclohexadecane; titanium(2+)

Systemtic Name: 2-phenyl-5,9,13-triaza-1-azanidacyclohexadecane; titanium(2+) Openeye Name: 2-phenyl-5,9,13-triaza-1-azanidacyclohexadecane; titanium(2+) CAS Name: 2-phenyl-5,9,13-triaza-1-azanidacyclohexadecane; titanium(2+) IUPAC Name: 2-phenyl-5,9,13-triaza-1-azanidacyclohexadecane; titanium(2+) Traditional Name: 2-phenyl-5,9,13-triaza-1-azanidacyclohexadecane; titanium(2+) Formula: C18H31N4Ti+ MolecularWeight: 351.33254

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCCNCCC([N-]CCCNC1)C2=CC=CC=C2.[Ti+2]

Isomeric SMILES

C1CNCCCNCCC([N-]CCCNC1)C2=CC=CC=C2.[Ti+2]

InChI

InChI=1S/C18H31N4.Ti/c1-2-7-17(8-3-1)18-9-16-21-13-5-12-19-10-4-11-20-14-6-15-22-18;/h1-3,7-8,18-21H,4-6,9-16H2;/q-1;+2