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

Systemtic Name: 5-but-3-ynyl-3-(3-nitrophenyl)-1,2-oxazole Openeye Name: 5-but-3-ynyl-3-(3-nitrophenyl)isoxazole CAS Name: 5-but-3-ynyl-3-(3-nitrophenyl)isoxazole IUPAC Name: 5-but-3-ynyl-3-(3-nitrophenyl)-1,2-oxazole Traditional Name: 5-but-3-ynyl-3-(3-nitrophenyl)isoxazole Formula: C13H10N2O3 MolecularWeight: 242.2301

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCC1=CC(=NO1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C#CCCC1=CC(=NO1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O3/c1-2-3-7-12-9-13(14-18-12)10-5-4-6-11(8-10)15(16)17/h1,4-6,8-9H,3,7H2