N-ethanoyl-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-tetradecoxy-benzamide

Systemtic Name: N-ethanoyl-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-tetradecoxy-benzamide Openeye Name: N-acetyl-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-tetradecoxy-benzamide CAS Name: N-acetyl-2-methyl-N-[(1-methyl-2-pyridin-1-iumyl)methyl]-4-tetradecoxybenzamide IUPAC Name: N-acetyl-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-tetradecoxybenzamide Traditional Name: N-acetyl-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-myristyloxy-benzamide Formula: C31H47N2O3+ MolecularWeight: 495.71648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2C)C(=O)C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2C)C(=O)C)C

InChI

InChI=1S/C31H47N2O3/c1-5-6-7-8-9-10-11-12-13-14-15-18-23-36-29-20-21-30(26(2)24-29)31(35)33(27(3)34)25-28-19-16-17-22-32(28)4/h16-17,19-22,24H,5-15,18,23,25H2,1-4H3/q+1