2-(3-methyl-4-nitro-phenyl)-5-nitro-1,3-benzoxazole

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O5/c1-8-6-9(2-4-12(8)17(20)21)14-15-11-7-10(16(18)19)3-5-13(11)22-14/h2-7H,1H3