N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(4-hexadecoxy-2-methyl-phenyl)methyl]benzamide

Systemtic Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(4-hexadecoxy-2-methyl-phenyl)methyl]benzamide Openeye Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(4-hexadecoxy-2-methyl-phenyl)methyl]benzamide CAS Name: N-[(1-ethyl-2-pyridin-1-iumyl)methyl]-N-[(4-hexadecoxy-2-methylphenyl)methyl]benzamide IUPAC Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(4-hexadecoxy-2-methylphenyl)methyl]benzamide Traditional Name: N-(4-cetyloxy-2-methyl-benzyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]benzamide Formula: C39H57N2O2+ MolecularWeight: 585.88208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)CN(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)CN(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C39H57N2O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-23-30-43-38-28-27-36(34(3)31-38)32-41(39(42)35-24-19-18-20-25-35)33-37-26-21-22-29-40(37)5-2/h18-22,24-29,31H,4-17,23,30,32-33H2,1-3H3/q+1