4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate; hexadecyl(trimethyl)azanium

Systemtic Name: 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate; hexadecyl(trimethyl)azanium Openeye Name: 4-amino-3,5,6-trichloro-pyridine-2-carboxylate; hexadecyl(trimethyl)ammonium CAS Name: 4-amino-3,5,6-trichloro-2-pyridinecarboxylate; hexadecyl(trimethyl)ammonium IUPAC Name: 4-amino-3,5,6-trichloropyridine-2-carboxylate; hexadecyl(trimethyl)azanium Traditional Name: 4-amino-3,5,6-trichloro-picolinate; cetyl(trimethyl)ammonium Formula: C25H44Cl3N3O2 MolecularWeight: 524.99476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)C.C1(=C(C(=NC(=C1Cl)Cl)C(=O)[O-])Cl)N

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)C.C1(=C(C(=NC(=C1Cl)Cl)C(=O)[O-])Cl)N

InChI

InChI=1S/C19H42N.C6H3Cl3N2O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;7-1-3(10)2(8)5(9)11-4(1)6(12)13/h5-19H2,1-4H3;(H2,10,11)(H,12,13)/q+1;/p-1