undecyl 2-[3-(phenylcarbamoyl)pyridin-1-ium-1-yl]ethanoate

Systemtic Name: undecyl 2-[3-(phenylcarbamoyl)pyridin-1-ium-1-yl]ethanoate Openeye Name: undecyl 2-[3-(phenylcarbamoyl)pyridin-1-ium-1-yl]acetate CAS Name: 2-[3-[anilino(oxo)methyl]-1-pyridin-1-iumyl]acetic acid undecyl ester IUPAC Name: undecyl 2-[3-(phenylcarbamoyl)pyridin-1-ium-1-yl]acetate Traditional Name: 2-[3-(phenylcarbamoyl)pyridin-1-ium-1-yl]acetic acid undecyl ester Formula: C25H35N2O3+ MolecularWeight: 411.557

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C[N+]1=CC=CC(=C1)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCOC(=O)C[N+]1=CC=CC(=C1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C25H34N2O3/c1-2-3-4-5-6-7-8-9-13-19-30-24(28)21-27-18-14-15-22(20-27)25(29)26-23-16-11-10-12-17-23/h10-12,14-18,20H,2-9,13,19,21H2,1H3/p+1