1-[2-(4-methyl-2-nitro-phenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-(4-methyl-2-nitro-phenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(4-methyl-2-nitro-phenoxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(4-methyl-2-nitrophenoxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(4-methyl-2-nitrophenoxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(4-methyl-2-nitro-phenoxy)ethyl]triazole-4-carboxylic acid Formula: C12H12N4O5 MolecularWeight: 292.24748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCN2C=C(N=N2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCCN2C=C(N=N2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O5/c1-8-2-3-11(10(6-8)16(19)20)21-5-4-15-7-9(12(17)18)13-14-15/h2-3,6-7H,4-5H2,1H3,(H,17,18)