ethyl 5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2,5-dinitro-pentanoate

Systemtic Name: ethyl 5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2,5-dinitro-pentanoate Openeye Name: ethyl 5-(4,4-dimethyl-5H-oxazol-2-yl)-2,5-dinitro-pentanoate CAS Name: 5-(4,4-dimethyl-5H-oxazol-2-yl)-2,5-dinitropentanoic acid ethyl ester IUPAC Name: ethyl 5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2,5-dinitropentanoate Traditional Name: 5-(4,4-dimethyl-2-oxazolin-2-yl)-2,5-dinitro-valeric acid ethyl ester Formula: C12H19N3O7 MolecularWeight: 317.29516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(C1=NC(CO1)(C)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(CCC(C1=NC(CO1)(C)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H19N3O7/c1-4-21-11(16)9(15(19)20)6-5-8(14(17)18)10-13-12(2,3)7-22-10/h8-9H,4-7H2,1-3H3