3-(12-iodanyldodecyl)-1-(13-pyridin-3-yltridecyl)pyridin-1-ium iodide

Systemtic Name: 3-(12-iodanyldodecyl)-1-(13-pyridin-3-yltridecyl)pyridin-1-ium iodide Openeye Name: 3-(12-iodododecyl)-1-[13-(3-pyridyl)tridecyl]pyridin-1-ium iodide CAS Name: 3-(12-iodododecyl)-1-[13-(3-pyridinyl)tridecyl]pyridin-1-ium iodide IUPAC Name: 3-(12-iodododecyl)-1-(13-pyridin-3-yltridecyl)pyridin-1-ium iodide Traditional Name: 3-(12-iodododecyl)-1-[13-(3-pyridyl)tridecyl]pyridin-1-ium iodide Formula: C35H58I2N2 MolecularWeight: 760.65736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCCCCCCCCCCC[N+]2=CC=CC(=C2)CCCCCCCCCCCCI.[I-]

Isomeric SMILES

C1=CC(=CN=C1)CCCCCCCCCCCCC[N+]2=CC=CC(=C2)CCCCCCCCCCCCI.[I-]

InChI

InChI=1S/C35H58IN2.HI/c36-28-20-16-12-8-4-3-7-11-15-19-25-35-27-23-31-38(33-35)30-21-17-13-9-5-1-2-6-10-14-18-24-34-26-22-29-37-32-34;/h22-23,26-27,29,31-33H,1-21,24-25,28,30H2;1H/q+1;/p-1