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

Systemtic Name: 5-cyclopropyl-1-(3-nitrophenyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-cyclopropyl-1-(3-nitrophenyl)triazole-4-carboxylic acid CAS Name: 5-cyclopropyl-1-(3-nitrophenyl)-4-triazolecarboxylic acid IUPAC Name: 5-cyclopropyl-1-(3-nitrophenyl)triazole-4-carboxylic acid Traditional Name: 5-cyclopropyl-1-(3-nitrophenyl)triazole-4-carboxylic acid Formula: C12H10N4O4 MolecularWeight: 274.2322

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(N=NN2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CC1C2=C(N=NN2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H10N4O4/c17-12(18)10-11(7-4-5-7)15(14-13-10)8-2-1-3-9(6-8)16(19)20/h1-3,6-7H,4-5H2,(H,17,18)