N-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-ethylpyridin-1-ium-4-yl)methyl]ethanamide

Systemtic Name: N-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-ethylpyridin-1-ium-4-yl)methyl]ethanamide Openeye Name: N-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-ethylpyridin-1-ium-4-yl)methyl]acetamide CAS Name: N-(4-dodecoxy-3-methoxyphenyl)-N-[(1-ethyl-4-pyridin-1-iumyl)methyl]acetamide IUPAC Name: N-(4-dodecoxy-3-methoxyphenyl)-N-[(1-ethylpyridin-1-ium-4-yl)methyl]acetamide Traditional Name: N-[(1-ethylpyridin-1-ium-4-yl)methyl]-N-(4-lauryloxy-3-methoxy-phenyl)acetamide Formula: C29H45N2O3+ MolecularWeight: 469.6792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)N(CC2=CC=[N+](C=C2)CC)C(=O)C)OC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)N(CC2=CC=[N+](C=C2)CC)C(=O)C)OC

InChI

InChI=1S/C29H45N2O3/c1-5-7-8-9-10-11-12-13-14-15-22-34-28-17-16-27(23-29(28)33-4)31(25(3)32)24-26-18-20-30(6-2)21-19-26/h16-21,23H,5-15,22,24H2,1-4H3/q+1