2-chloranyl-N-[(4-dodecoxy-3-methoxy-phenyl)methyl]-N-[(1-ethylpyridin-1-ium-2-yl)methyl]benzamide iodide

Systemtic Name: 2-chloranyl-N-[(4-dodecoxy-3-methoxy-phenyl)methyl]-N-[(1-ethylpyridin-1-ium-2-yl)methyl]benzamide iodide Openeye Name: 2-chloro-N-[(4-dodecoxy-3-methoxy-phenyl)methyl]-N-[(1-ethylpyridin-1-ium-2-yl)methyl]benzamide iodide CAS Name: 2-chloro-N-[(4-dodecoxy-3-methoxyphenyl)methyl]-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]benzamide iodide IUPAC Name: 2-chloro-N-[(4-dodecoxy-3-methoxyphenyl)methyl]-N-[(1-ethylpyridin-1-ium-2-yl)methyl]benzamide iodide Traditional Name: 2-chloro-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(4-lauryloxy-3-methoxy-benzyl)benzamide iodide Formula: C35H48ClIN2O3 MolecularWeight: 707.12469

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3Cl)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3Cl)OC.[I-]

InChI

InChI=1S/C35H48ClN2O3.HI/c1-4-6-7-8-9-10-11-12-13-18-25-41-33-23-22-29(26-34(33)40-3)27-38(28-30-19-16-17-24-37(30)5-2)35(39)31-20-14-15-21-32(31)36;/h14-17,19-24,26H,4-13,18,25,27-28H2,1-3H3;1H/q+1;/p-1