2-(5-methyl-2-oxidanyl-phenyl)-1-oxidanidyl-benzotriazol-1-ium-5-carboxylic acid

Systemtic Name: 2-(5-methyl-2-oxidanyl-phenyl)-1-oxidanidyl-benzotriazol-1-ium-5-carboxylic acid Openeye Name: 2-(2-hydroxy-5-methyl-phenyl)-1-oxido-benzotriazol-1-ium-5-carboxylic acid CAS Name: 2-(2-hydroxy-5-methylphenyl)-1-oxido-5-benzotriazol-1-iumcarboxylic acid IUPAC Name: 2-(2-hydroxy-5-methylphenyl)-1-oxidobenzotriazol-1-ium-5-carboxylic acid Traditional Name: 2-(2-hydroxy-5-methyl-phenyl)-1-oxido-benzotriazol-1-ium-5-carboxylic acid Formula: C14H11N3O4 MolecularWeight: 285.25484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)N2N=C3C=C(C=CC3=[N+]2[O-])C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)O)N2N=C3C=C(C=CC3=[N+]2[O-])C(=O)O

InChI

InChI=1S/C14H11N3O4/c1-8-2-5-13(18)12(6-8)16-15-10-7-9(14(19)20)3-4-11(10)17(16)21/h2-7,18H,1H3,(H,19,20)