N-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]ethanamide

Systemtic Name: N-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]ethanamide Openeye Name: N-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]acetamide CAS Name: N-(4-dodecoxy-3-methoxyphenyl)-N-[(1-propyl-2-pyridin-1-iumyl)methyl]acetamide IUPAC Name: N-(4-dodecoxy-3-methoxyphenyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]acetamide Traditional Name: N-(4-lauryloxy-3-methoxy-phenyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]acetamide Formula: C30H47N2O3+ MolecularWeight: 483.70578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)N(CC2=CC=CC=[N+]2CCC)C(=O)C)OC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)N(CC2=CC=CC=[N+]2CCC)C(=O)C)OC

InChI

InChI=1S/C30H47N2O3/c1-5-7-8-9-10-11-12-13-14-17-23-35-29-20-19-27(24-30(29)34-4)32(26(3)33)25-28-18-15-16-22-31(28)21-6-2/h15-16,18-20,22,24H,5-14,17,21,23,25H2,1-4H3/q+1