N-[(3-chloranyl-2-tetradecoxy-phenyl)methyl]-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-methoxy-benzamide iodide

Systemtic Name: N-[(3-chloranyl-2-tetradecoxy-phenyl)methyl]-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-methoxy-benzamide iodide Openeye Name: N-[(3-chloro-2-tetradecoxy-phenyl)methyl]-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-methoxy-benzamide iodide CAS Name: N-[(3-chloro-2-tetradecoxyphenyl)methyl]-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]-2-methoxybenzamide iodide IUPAC Name: N-[(3-chloro-2-tetradecoxyphenyl)methyl]-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-methoxybenzamide iodide Traditional Name: N-(3-chloro-2-myristyloxy-benzyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-methoxy-benzamide iodide Formula: C37H52ClIN2O3 MolecularWeight: 735.17785

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC=C1Cl)CN(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1Cl)CN(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3OC.[I-]

InChI

InChI=1S/C37H52ClN2O3.HI/c1-4-6-7-8-9-10-11-12-13-14-15-20-28-43-36-31(22-21-25-34(36)38)29-40(30-32-23-18-19-27-39(32)5-2)37(41)33-24-16-17-26-35(33)42-3;/h16-19,21-27H,4-15,20,28-30H2,1-3H3;1H/q+1;/p-1