4-nitro-2-[3-(4-nitro-1,3-benzoxazol-2-yl)propyl]-1,3-benzoxazole

Systemtic Name: 4-nitro-2-[3-(4-nitro-1,3-benzoxazol-2-yl)propyl]-1,3-benzoxazole Openeye Name: 4-nitro-2-[3-(4-nitro-1,3-benzoxazol-2-yl)propyl]-1,3-benzoxazole CAS Name: 4-nitro-2-[3-(4-nitro-1,3-benzoxazol-2-yl)propyl]-1,3-benzoxazole IUPAC Name: 4-nitro-2-[3-(4-nitro-1,3-benzoxazol-2-yl)propyl]-1,3-benzoxazole Traditional Name: 4-nitro-2-[3-(4-nitro-1,3-benzoxazol-2-yl)propyl]-1,3-benzoxazole Formula: C17H12N4O6 MolecularWeight: 368.30038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC(=N2)CCCC3=NC4=C(C=CC=C4O3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C(=C1)OC(=N2)CCCC3=NC4=C(C=CC=C4O3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O6/c22-20(23)10-4-1-6-12-16(10)18-14(26-12)8-3-9-15-19-17-11(21(24)25)5-2-7-13(17)27-15/h1-2,4-7H,3,8-9H2