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

Systemtic Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-(4-hexadecoxy-3-methoxy-phenyl)ethanamide Openeye Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-(4-hexadecoxy-3-methoxy-phenyl)acetamide CAS Name: N-[(1-ethyl-2-pyridin-1-iumyl)methyl]-2-(4-hexadecoxy-3-methoxyphenyl)acetamide IUPAC Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-(4-hexadecoxy-3-methoxyphenyl)acetamide Traditional Name: 2-(4-cetyloxy-3-methoxy-phenyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]acetamide Formula: C33H53N2O3+ MolecularWeight: 525.78552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NCC2=CC=CC=[N+]2CC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NCC2=CC=CC=[N+]2CC)OC

InChI

InChI=1S/C33H52N2O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-20-25-38-31-23-22-29(26-32(31)37-3)27-33(36)34-28-30-21-18-19-24-35(30)5-2/h18-19,21-24,26H,4-17,20,25,27-28H2,1-3H3/p+1