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

Systemtic Name: 2-chloranyl-N-[(2-methyl-3-tetradecoxy-phenyl)methyl]-N-[(1-propylpyridin-1-ium-4-yl)methyl]benzamide iodide Openeye Name: 2-chloro-N-[(2-methyl-3-tetradecoxy-phenyl)methyl]-N-[(1-propylpyridin-1-ium-4-yl)methyl]benzamide iodide CAS Name: 2-chloro-N-[(2-methyl-3-tetradecoxyphenyl)methyl]-N-[(1-propyl-4-pyridin-1-iumyl)methyl]benzamide iodide IUPAC Name: 2-chloro-N-[(2-methyl-3-tetradecoxyphenyl)methyl]-N-[(1-propylpyridin-1-ium-4-yl)methyl]benzamide iodide Traditional Name: 2-chloro-N-(2-methyl-3-myristyloxy-benzyl)-N-[(1-propylpyridin-1-ium-4-yl)methyl]benzamide iodide Formula: C38H54ClIN2O2 MolecularWeight: 733.20503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC(=C1C)CN(CC2=CC=[N+](C=C2)CCC)C(=O)C3=CC=CC=C3Cl.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC(=C1C)CN(CC2=CC=[N+](C=C2)CCC)C(=O)C3=CC=CC=C3Cl.[I-]

InChI

InChI=1S/C38H54ClN2O2.HI/c1-4-6-7-8-9-10-11-12-13-14-15-18-29-43-37-23-19-20-34(32(37)3)31-41(38(42)35-21-16-17-22-36(35)39)30-33-24-27-40(26-5-2)28-25-33;/h16-17,19-25,27-28H,4-15,18,26,29-31H2,1-3H3;1H/q+1;/p-1