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

Systemtic Name: N-ethanoyl-N-[3-(1-ethylpyridin-1-ium-2-yl)propyl]-3-methoxy-4-tetradecoxy-benzamide iodide Openeye Name: N-acetyl-N-[3-(1-ethylpyridin-1-ium-2-yl)propyl]-3-methoxy-4-tetradecoxy-benzamide iodide CAS Name: N-acetyl-N-[3-(1-ethyl-2-pyridin-1-iumyl)propyl]-3-methoxy-4-tetradecoxybenzamide iodide IUPAC Name: N-acetyl-N-[3-(1-ethylpyridin-1-ium-2-yl)propyl]-3-methoxy-4-tetradecoxybenzamide iodide Traditional Name: N-acetyl-N-[3-(1-ethylpyridin-1-ium-2-yl)propyl]-3-methoxy-4-myristyloxy-benzamide iodide Formula: C34H53IN2O4 MolecularWeight: 680.70009

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)N(CCCC2=CC=CC=[N+]2CC)C(=O)C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)N(CCCC2=CC=CC=[N+]2CC)C(=O)C)OC.[I-]

InChI

InChI=1S/C34H53N2O4.HI/c1-5-7-8-9-10-11-12-13-14-15-16-19-27-40-32-24-23-30(28-33(32)39-4)34(38)36(29(3)37)26-20-22-31-21-17-18-25-35(31)6-2;/h17-18,21,23-25,28H,5-16,19-20,22,26-27H2,1-4H3;1H/q+1;/p-1