2-[4-[1-[(4-tert-butylphenyl)methyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethyl-triethyl-phosphanium

Systemtic Name: 2-[4-[1-[(4-tert-butylphenyl)methyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethyl-triethyl-phosphanium Openeye Name: 2-[4-[1-[(4-tert-butylphenyl)methyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethyl-triethyl-phosphonium CAS Name: 2-[4-[1-[(4-tert-butylphenyl)methyl]-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]ethyl-triethylphosphonium IUPAC Name: 2-[4-[1-[(4-tert-butylphenyl)methyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethyl-triethylphosphanium Traditional Name: 2-[4-[1-(4-tert-butylbenzyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethyl-triethyl-phosphonium Formula: C29H42N2P+3 MolecularWeight: 449.630941

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Descriptors Computed from Structure

Canonical SMILES:

CC[P+](CC)(CC)CC[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC[P+](CC)(CC)CC[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C29H42N2P/c1-7-32(8-2,9-3)23-22-30-18-14-26(15-19-30)27-16-20-31(21-17-27)24-25-10-12-28(13-11-25)29(4,5)6/h10-21H,7-9,22-24H2,1-6H3/q+3