N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(phenylcarbonyl)-3,4-di(tetradecoxy)benzamide iodide

Systemtic Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(phenylcarbonyl)-3,4-di(tetradecoxy)benzamide iodide Openeye Name: N-benzoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-3,4-di(tetradecoxy)benzamide iodide CAS Name: N-benzoyl-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]-3,4-di(tetradecoxy)benzamide iodide IUPAC Name: N-benzoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-3,4-di(tetradecoxy)benzamide iodide Traditional Name: N-benzoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-3,4-dimyristyloxy-benzamide iodide Formula: C50H77IN2O4 MolecularWeight: 897.06185

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3)OCCCCCCCCCCCCCC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3)OCCCCCCCCCCCCCC.[I-]

InChI

InChI=1S/C50H77N2O4.HI/c1-4-7-9-11-13-15-17-19-21-23-25-32-40-55-47-38-37-45(42-48(47)56-41-33-26-24-22-20-18-16-14-12-10-8-5-2)50(54)52(49(53)44-34-28-27-29-35-44)43-46-36-30-31-39-51(46)6-3;/h27-31,34-39,42H,4-26,32-33,40-41,43H2,1-3H3;1H/q+1;/p-1