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

Systemtic Name: N-[(1-ethylpyridin-1-ium-4-yl)methyl]-2-methoxy-N-[(2-methyl-3-tetradecoxy-phenyl)methyl]benzamide iodide Openeye Name: N-[(1-ethylpyridin-1-ium-4-yl)methyl]-2-methoxy-N-[(2-methyl-3-tetradecoxy-phenyl)methyl]benzamide iodide CAS Name: N-[(1-ethyl-4-pyridin-1-iumyl)methyl]-2-methoxy-N-[(2-methyl-3-tetradecoxyphenyl)methyl]benzamide iodide IUPAC Name: N-[(1-ethylpyridin-1-ium-4-yl)methyl]-2-methoxy-N-[(2-methyl-3-tetradecoxyphenyl)methyl]benzamide iodide Traditional Name: N-[(1-ethylpyridin-1-ium-4-yl)methyl]-2-methoxy-N-(2-methyl-3-myristyloxy-benzyl)benzamide iodide Formula: C38H55IN2O3 MolecularWeight: 714.75937

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC(=C1C)CN(CC2=CC=[N+](C=C2)CC)C(=O)C3=CC=CC=C3OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC(=C1C)CN(CC2=CC=[N+](C=C2)CC)C(=O)C3=CC=CC=C3OC.[I-]

InChI

InChI=1S/C38H55N2O3.HI/c1-5-7-8-9-10-11-12-13-14-15-16-19-29-43-36-24-20-21-34(32(36)3)31-40(30-33-25-27-39(6-2)28-26-33)38(41)35-22-17-18-23-37(35)42-4;/h17-18,20-28H,5-16,19,29-31H2,1-4H3;1H/q+1;/p-1