5-but-3-ynyl-1-(3-nitrophenyl)-1,2,3-triazole

Systemtic Name: 5-but-3-ynyl-1-(3-nitrophenyl)-1,2,3-triazole Openeye Name: 5-but-3-ynyl-1-(3-nitrophenyl)triazole CAS Name: 5-but-3-ynyl-1-(3-nitrophenyl)triazole IUPAC Name: 5-but-3-ynyl-1-(3-nitrophenyl)triazole Traditional Name: 5-but-3-ynyl-1-(3-nitrophenyl)triazole Formula: C12H10N4O2 MolecularWeight: 242.2334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N4O2/c1-2-3-5-12-9-13-14-15(12)10-6-4-7-11(8-10)16(17)18/h1,4,6-9H,3,5H2