6-[(2,4-dichlorophenyl)methyl]-1-methyl-indazol-1-ium-1-carboxylic acid

Systemtic Name: 6-[(2,4-dichlorophenyl)methyl]-1-methyl-indazol-1-ium-1-carboxylic acid Openeye Name: 6-[(2,4-dichlorophenyl)methyl]-1-methyl-indazol-1-ium-1-carboxylic acid CAS Name: 6-[(2,4-dichlorophenyl)methyl]-1-methyl-1-indazol-1-iumcarboxylic acid IUPAC Name: 6-[(2,4-dichlorophenyl)methyl]-1-methylindazol-1-ium-1-carboxylic acid Traditional Name: 6-(2,4-dichlorobenzyl)-1-methyl-indazol-1-ium-1-carboxylic acid Formula: C16H13Cl2N2O2+ MolecularWeight: 336.19262

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2=C(C=CC(=C2)CC3=C(C=C(C=C3)Cl)Cl)C=N1)C(=O)O

Isomeric SMILES

C[N+]1(C2=C(C=CC(=C2)CC3=C(C=C(C=C3)Cl)Cl)C=N1)C(=O)O

InChI

InChI=1S/C16H12Cl2N2O2/c1-20(16(21)22)15-7-10(2-3-12(15)9-19-20)6-11-4-5-13(17)8-14(11)18/h2-5,7-9H,6H2,1H3/p+1