N-(2-ethylhexyl)-1-[7-[4-(2-ethylhexylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine

Systemtic Name: N-(2-ethylhexyl)-1-[7-[4-(2-ethylhexylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine Openeye Name: N-(2-ethylhexyl)-1-[7-[4-(2-ethylhexylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine CAS Name: N-(2-ethylhexyl)-1-[7-[4-(2-ethylhexylamino)-1-pyridin-1-iumyl]heptyl]-4-pyridin-1-iumamine IUPAC Name: N-(2-ethylhexyl)-1-[7-[4-(2-ethylhexylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine Traditional Name: 2-ethylhexyl-[1-[7-[4-(2-ethylhexylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-yl]amine Formula: C33H58N4+2 MolecularWeight: 510.84042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC1=CC=[N+](C=C1)CCCCCCC[N+]2=CC=C(C=C2)NCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)CNC1=CC=[N+](C=C1)CCCCCCC[N+]2=CC=C(C=C2)NCC(CC)CCCC

InChI

InChI=1S/C33H56N4/c1-5-9-16-30(7-3)28-34-32-18-24-36(25-19-32)22-14-12-11-13-15-23-37-26-20-33(21-27-37)35-29-31(8-4)17-10-6-2/h18-21,24-27,30-31H,5-17,22-23,28-29H2,1-4H3/p+2