2,6-dinitro-3-(1H-pyrrol-2-yl)-2H-1,3-benzoxazole

Systemtic Name: 2,6-dinitro-3-(1H-pyrrol-2-yl)-2H-1,3-benzoxazole Openeye Name: 2,6-dinitro-3-(1H-pyrrol-2-yl)-2H-1,3-benzoxazole CAS Name: 2,6-dinitro-3-(1H-pyrrol-2-yl)-2H-1,3-benzoxazole IUPAC Name: 2,6-dinitro-3-(1H-pyrrol-2-yl)-2H-1,3-benzoxazole Traditional Name: 2,6-dinitro-3-(1H-pyrrol-2-yl)-2H-1,3-benzoxazole Formula: C11H8N4O5 MolecularWeight: 276.20502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C1)N2C(OC3=C2C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CNC(=C1)N2C(OC3=C2C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H8N4O5/c16-14(17)7-3-4-8-9(6-7)20-11(15(18)19)13(8)10-2-1-5-12-10/h1-6,11-12H