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

Systemtic Name: 1-(2-nitrophenyl)-5-propyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(2-nitrophenyl)-5-propyl-triazole-4-carboxylic acid CAS Name: 1-(2-nitrophenyl)-5-propyl-4-triazolecarboxylic acid IUPAC Name: 1-(2-nitrophenyl)-5-propyltriazole-4-carboxylic acid Traditional Name: 1-(2-nitrophenyl)-5-propyl-triazole-4-carboxylic acid Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCCC1=C(N=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H12N4O4/c1-2-5-10-11(12(17)18)13-14-15(10)8-6-3-4-7-9(8)16(19)20/h3-4,6-7H,2,5H2,1H3,(H,17,18)