4-hexadecoxy-3-methoxy-N-(2-methoxyphenyl)carbonyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]benzamide iodide

Systemtic Name: 4-hexadecoxy-3-methoxy-N-(2-methoxyphenyl)carbonyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]benzamide iodide Openeye Name: 4-hexadecoxy-3-methoxy-N-(2-methoxybenzoyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]benzamide iodide CAS Name: 4-hexadecoxy-3-methoxy-N-[(2-methoxyphenyl)-oxomethyl]-N-[(1-propyl-2-pyridin-1-iumyl)methyl]benzamide iodide IUPAC Name: 4-hexadecoxy-3-methoxy-N-(2-methoxybenzoyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]benzamide iodide Traditional Name: 4-cetyloxy-3-methoxy-N-o-anisoyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]benzamide iodide Formula: C41H59IN2O5 MolecularWeight: 786.82203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2CCC)C(=O)C3=CC=CC=C3OC)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2CCC)C(=O)C3=CC=CC=C3OC)OC.[I-]

InChI

InChI=1S/C41H59N2O5.HI/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-23-31-48-38-28-27-34(32-39(38)47-4)40(44)43(33-35-24-21-22-30-42(35)29-6-2)41(45)36-25-19-20-26-37(36)46-3;/h19-22,24-28,30,32H,5-18,23,29,31,33H2,1-4H3;1H/q+1;/p-1