5-methyl-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 5-methyl-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-methyl-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylic acid CAS Name: 5-methyl-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylic acid IUPAC Name: 5-methyl-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-methyl-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylic acid Formula: C10H8N4O4 MolecularWeight: 248.19492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C10H8N4O4/c1-6-11-9(10(15)16)12-13(6)7-2-4-8(5-3-7)14(17)18/h2-5H,1H3,(H,15,16)