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

Systemtic Name: 2-chloranyl-N-[(3-methoxy-4-tetradecoxy-phenyl)methyl]-N-[(1-propylpyridin-1-ium-3-yl)methyl]benzamide iodide Openeye Name: 2-chloro-N-[(3-methoxy-4-tetradecoxy-phenyl)methyl]-N-[(1-propylpyridin-1-ium-3-yl)methyl]benzamide iodide CAS Name: 2-chloro-N-[(3-methoxy-4-tetradecoxyphenyl)methyl]-N-[(1-propyl-3-pyridin-1-iumyl)methyl]benzamide iodide IUPAC Name: 2-chloro-N-[(3-methoxy-4-tetradecoxyphenyl)methyl]-N-[(1-propylpyridin-1-ium-3-yl)methyl]benzamide iodide Traditional Name: 2-chloro-N-(3-methoxy-4-myristyloxy-benzyl)-N-[(1-propylpyridin-1-ium-3-yl)methyl]benzamide iodide Formula: C38H54ClIN2O3 MolecularWeight: 749.20443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=C[N+](=CC=C2)CCC)C(=O)C3=CC=CC=C3Cl)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=C[N+](=CC=C2)CCC)C(=O)C3=CC=CC=C3Cl)OC.[I-]

InChI

InChI=1S/C38H54ClN2O3.HI/c1-4-6-7-8-9-10-11-12-13-14-15-18-27-44-36-24-23-32(28-37(36)43-3)30-41(38(42)34-21-16-17-22-35(34)39)31-33-20-19-26-40(29-33)25-5-2;/h16-17,19-24,26,28-29H,4-15,18,25,27,30-31H2,1-3H3;1H/q+1;/p-1