1-[2-(3-nitrophenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-(3-nitrophenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(3-nitrophenoxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(3-nitrophenoxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(3-nitrophenoxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(3-nitrophenoxy)ethyl]triazole-4-carboxylic acid Formula: C11H10N4O5 MolecularWeight: 278.2209

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10N4O5/c16-11(17)10-7-14(13-12-10)4-5-20-9-3-1-2-8(6-9)15(18)19/h1-3,6-7H,4-5H2,(H,16,17)