5-chloranyl-7-nitro-3-(4-nitrophenyl)-2,1-benzoxazole

Systemtic Name: 5-chloranyl-7-nitro-3-(4-nitrophenyl)-2,1-benzoxazole Openeye Name: 5-chloro-7-nitro-3-(4-nitrophenyl)-2,1-benzoxazole CAS Name: 5-chloro-7-nitro-3-(4-nitrophenyl)-2,1-benzoxazole IUPAC Name: 5-chloro-7-nitro-3-(4-nitrophenyl)-2,1-benzoxazole Traditional Name: 5-chloro-7-nitro-3-(4-nitrophenyl)anthranil Formula: C13H6ClN3O5 MolecularWeight: 319.65684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=C(C=C(C3=NO2)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=C(C=C(C3=NO2)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H6ClN3O5/c14-8-5-10-12(11(6-8)17(20)21)15-22-13(10)7-1-3-9(4-2-7)16(18)19/h1-6H