5-nitro-2-[(4-nitrophenyl)methyl]-1,3-benzoxazole

Systemtic Name: 5-nitro-2-[(4-nitrophenyl)methyl]-1,3-benzoxazole Openeye Name: 5-nitro-2-[(4-nitrophenyl)methyl]-1,3-benzoxazole CAS Name: 5-nitro-2-[(4-nitrophenyl)methyl]-1,3-benzoxazole IUPAC Name: 5-nitro-2-[(4-nitrophenyl)methyl]-1,3-benzoxazole Traditional Name: 5-nitro-2-(4-nitrobenzyl)-1,3-benzoxazole Formula: C14H9N3O5 MolecularWeight: 299.23836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O5/c18-16(19)10-3-1-9(2-4-10)7-14-15-12-8-11(17(20)21)5-6-13(12)22-14/h1-6,8H,7H2