2-[6-[3,5-bis(chloranyl)pyridin-2-yl]oxy-1-methyl-benzotriazol-1-ium-1-yl]ethanoate; methane

Systemtic Name: 2-[6-[3,5-bis(chloranyl)pyridin-2-yl]oxy-1-methyl-benzotriazol-1-ium-1-yl]ethanoate; methane Openeye Name: 2-[6-[(3,5-dichloro-2-pyridyl)oxy]-1-methyl-benzotriazol-1-ium-1-yl]acetate; methane CAS Name: 2-[6-[(3,5-dichloro-2-pyridinyl)oxy]-1-methyl-1-benzotriazol-1-iumyl]acetate; methane IUPAC Name: 2-[6-(3,5-dichloropyridin-2-yl)oxy-1-methylbenzotriazol-1-ium-1-yl]acetate; methane Traditional Name: 2-[6-[(3,5-dichloro-2-pyridyl)oxy]-1-methyl-benzotriazol-1-ium-1-yl]acetate; methane Formula: C15H14Cl2N4O3 MolecularWeight: 369.20266

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Descriptors Computed from Structure

Canonical SMILES:

C.C[N+]1(C2=C(C=CC(=C2)OC3=C(C=C(C=N3)Cl)Cl)N=N1)CC(=O)[O-]

Isomeric SMILES

C.C[N+]1(C2=C(C=CC(=C2)OC3=C(C=C(C=N3)Cl)Cl)N=N1)CC(=O)[O-]

InChI

InChI=1S/C14H10Cl2N4O3.CH4/c1-20(7-13(21)22)12-5-9(2-3-11(12)18-19-20)23-14-10(16)4-8(15)6-17-14;/h2-6H,7H2,1H3;1H4