3-[(E)-5-(4-azido-2-nitro-phenoxy)-4-methyl-pent-3-enyl]-2,2-dimethyl-oxirane

Systemtic Name: 3-[(E)-5-(4-azido-2-nitro-phenoxy)-4-methyl-pent-3-enyl]-2,2-dimethyl-oxirane Openeye Name: 3-[(E)-5-(4-azido-2-nitro-phenoxy)-4-methyl-pent-3-enyl]-2,2-dimethyl-oxirane CAS Name: 3-[(E)-5-(4-azido-2-nitrophenoxy)-4-methylpent-3-enyl]-2,2-dimethyloxirane IUPAC Name: 3-[(E)-5-(4-azido-2-nitrophenoxy)-4-methylpent-3-enyl]-2,2-dimethyloxirane Traditional Name: 3-[(E)-5-(4-azido-2-nitro-phenoxy)-4-methyl-pent-3-enyl]-2,2-dimethyl-oxirane Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC1C(O1)(C)C)COC2=C(C=C(C=C2)N=[N+]=[N-])[N+](=O)[O-]

Isomeric SMILES

C/C(=C\CCC1C(O1)(C)C)/COC2=C(C=C(C=C2)N=[N+]=[N-])[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O4/c1-11(5-4-6-15-16(2,3)24-15)10-23-14-8-7-12(18-19-17)9-13(14)20(21)22/h5,7-9,15H,4,6,10H2,1-3H3/b11-5+