3-[(8-methyl-7-oxidanyl-naphthalen-2-yl)sulfanylperoxyamino]-1H-1,2,4-triazole-5-carboxylic acid

Systemtic Name: 3-[(8-methyl-7-oxidanyl-naphthalen-2-yl)sulfanylperoxyamino]-1H-1,2,4-triazole-5-carboxylic acid Openeye Name: 3-[(7-hydroxy-8-methyl-2-naphthyl)sulfanylperoxyamino]-1H-1,2,4-triazole-5-carboxylic acid CAS Name: 3-[[(7-hydroxy-8-methyl-2-naphthalenyl)thio]dioxyamino]-1H-1,2,4-triazole-5-carboxylic acid IUPAC Name: 3-[(7-hydroxy-8-methylnaphthalen-2-yl)sulfanylperoxyamino]-1H-1,2,4-triazole-5-carboxylic acid Traditional Name: 3-[[(7-hydroxy-8-methyl-2-naphthyl)thio]peroxyamino]-1H-1,2,4-triazole-5-carboxylic acid Formula: C14H12N4O5S MolecularWeight: 348.33388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C=C(C=C2)SOONC3=NNC(=N3)C(=O)O)O

Isomeric SMILES

CC1=C(C=CC2=C1C=C(C=C2)SOONC3=NNC(=N3)C(=O)O)O

InChI

InChI=1S/C14H12N4O5S/c1-7-10-6-9(4-2-8(10)3-5-11(7)19)24-23-22-18-14-15-12(13(20)21)16-17-14/h2-6,19H,1H3,(H,20,21)(H2,15,16,17,18)