1-[2-(dodecylamino)-2-oxidanylidene-ethyl]-N-phenyl-pyridin-1-ium-3-carboxamide chloride

Systemtic Name: 1-[2-(dodecylamino)-2-oxidanylidene-ethyl]-N-phenyl-pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-[2-(dodecylamino)-2-oxo-ethyl]-N-phenyl-pyridin-1-ium-3-carboxamide chloride CAS Name: 1-[2-(dodecylamino)-2-oxoethyl]-N-phenyl-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[2-(dodecylamino)-2-oxoethyl]-N-phenylpyridin-1-ium-3-carboxamide chloride Traditional Name: 1-[2-keto-2-(laurylamino)ethyl]-N-phenyl-pyridin-1-ium-3-carboxamide chloride Formula: C26H38ClN3O2 MolecularWeight: 460.05182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)C[N+]1=CC=CC(=C1)C(=O)NC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCNC(=O)C[N+]1=CC=CC(=C1)C(=O)NC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C26H37N3O2.ClH/c1-2-3-4-5-6-7-8-9-10-14-19-27-25(30)22-29-20-15-16-23(21-29)26(31)28-24-17-12-11-13-18-24;/h11-13,15-18,20-21H,2-10,14,19,22H2,1H3,(H-,27,28,30,31);1H