(2,4-dinitrophenyl) 2-chloranyl-2-ethyl-3-methyl-pentanoate

Systemtic Name: (2,4-dinitrophenyl) 2-chloranyl-2-ethyl-3-methyl-pentanoate Openeye Name: (2,4-dinitrophenyl) 2-chloro-2-ethyl-3-methyl-pentanoate CAS Name: 2-chloro-2-ethyl-3-methylpentanoic acid (2,4-dinitrophenyl) ester IUPAC Name: (2,4-dinitrophenyl) 2-chloro-2-ethyl-3-methylpentanoate Traditional Name: 2-chloro-2-ethyl-3-methyl-valeric acid (2,4-dinitrophenyl) ester Formula: C14H17ClN2O6 MolecularWeight: 344.74758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CC)(C(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

CCC(C)C(CC)(C(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C14H17ClN2O6/c1-4-9(3)14(15,5-2)13(18)23-12-7-6-10(16(19)20)8-11(12)17(21)22/h6-9H,4-5H2,1-3H3