N-[(3-chloranyl-4-tetradecoxy-phenyl)methyl]-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide

Systemtic Name: N-[(3-chloranyl-4-tetradecoxy-phenyl)methyl]-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide Openeye Name: N-[(3-chloro-4-tetradecoxy-phenyl)methyl]-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide CAS Name: N-[(3-chloro-4-tetradecoxyphenyl)methyl]-N-[(1-methyl-4-pyridin-1-iumyl)methyl]benzamide IUPAC Name: N-[(3-chloro-4-tetradecoxyphenyl)methyl]-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide Traditional Name: N-(3-chloro-4-myristyloxy-benzyl)-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide Formula: C35H48ClN2O2+ MolecularWeight: 564.22082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=CC=[N+](C=C2)C)C(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=CC=[N+](C=C2)C)C(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C35H48ClN2O2/c1-3-4-5-6-7-8-9-10-11-12-13-17-26-40-34-21-20-31(27-33(34)36)29-38(28-30-22-24-37(2)25-23-30)35(39)32-18-15-14-16-19-32/h14-16,18-25,27H,3-13,17,26,28-29H2,1-2H3/q+1