N-[(3-chloranyl-2-tetradecoxy-phenyl)methyl]-N-[(1-propylpyridin-1-ium-4-yl)methyl]ethanamide iodide

Systemtic Name: N-[(3-chloranyl-2-tetradecoxy-phenyl)methyl]-N-[(1-propylpyridin-1-ium-4-yl)methyl]ethanamide iodide Openeye Name: N-[(3-chloro-2-tetradecoxy-phenyl)methyl]-N-[(1-propylpyridin-1-ium-4-yl)methyl]acetamide iodide CAS Name: N-[(3-chloro-2-tetradecoxyphenyl)methyl]-N-[(1-propyl-4-pyridin-1-iumyl)methyl]acetamide iodide IUPAC Name: N-[(3-chloro-2-tetradecoxyphenyl)methyl]-N-[(1-propylpyridin-1-ium-4-yl)methyl]acetamide iodide Traditional Name: N-(3-chloro-2-myristyloxy-benzyl)-N-[(1-propylpyridin-1-ium-4-yl)methyl]acetamide iodide Formula: C32H50ClIN2O2 MolecularWeight: 657.10907

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC=C1Cl)CN(CC2=CC=[N+](C=C2)CCC)C(=O)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1Cl)CN(CC2=CC=[N+](C=C2)CCC)C(=O)C.[I-]

InChI

InChI=1S/C32H50ClN2O2.HI/c1-4-6-7-8-9-10-11-12-13-14-15-16-25-37-32-30(18-17-19-31(32)33)27-35(28(3)36)26-29-20-23-34(22-5-2)24-21-29;/h17-21,23-24H,4-16,22,25-27H2,1-3H3;1H/q+1;/p-1