2-(3-nitroprop-2-ynoxy)-5-phenyl-1,3-benzoxazole

Systemtic Name: 2-(3-nitroprop-2-ynoxy)-5-phenyl-1,3-benzoxazole Openeye Name: 2-(3-nitroprop-2-ynoxy)-5-phenyl-1,3-benzoxazole CAS Name: 2-(3-nitroprop-2-ynoxy)-5-phenyl-1,3-benzoxazole IUPAC Name: 2-(3-nitroprop-2-ynoxy)-5-phenyl-1,3-benzoxazole Traditional Name: 2-(3-nitroprop-2-ynoxy)-5-phenyl-1,3-benzoxazole Formula: C16H10N2O4 MolecularWeight: 294.2616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=N3)OCC#C[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=N3)OCC#C[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O4/c19-18(20)9-4-10-21-16-17-14-11-13(7-8-15(14)22-16)12-5-2-1-3-6-12/h1-3,5-8,11H,10H2