N,N-di(pentadecyl)-2-[(E)-2-phenylethenyl]pyridin-1-ium-1-amine iodide

Systemtic Name: N,N-di(pentadecyl)-2-[(E)-2-phenylethenyl]pyridin-1-ium-1-amine iodide Openeye Name: N,N-di(pentadecyl)-2-[(E)-styryl]pyridin-1-ium-1-amine iodide CAS Name: N,N-di(pentadecyl)-2-[(E)-2-phenylethenyl]-1-pyridin-1-iumamine iodide IUPAC Name: N,N-di(pentadecyl)-2-[(E)-2-phenylethenyl]pyridin-1-ium-1-amine iodide Traditional Name: di(pentadecyl)-[2-[(E)-styryl]pyridin-1-ium-1-yl]amine iodide Formula: C43H73IN2 MolecularWeight: 744.95759

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCC)[N+]1=CC=CC=C1C=CC2=CC=CC=C2.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCC)[N+]1=CC=CC=C1/C=C/C2=CC=CC=C2.[I-]

InChI

InChI=1S/C43H73N2.HI/c1-3-5-7-9-11-13-15-17-19-21-23-25-31-39-44(40-32-26-24-22-20-18-16-14-12-10-8-6-4-2)45-41-33-30-36-43(45)38-37-42-34-28-27-29-35-42;/h27-30,33-38,41H,3-26,31-32,39-40H2,1-2H3;1H/q+1;/p-1/b38-37+;