(2,4-dinitrophenyl) 2-propan-2-ylidenehexanoate

Systemtic Name: (2,4-dinitrophenyl) 2-propan-2-ylidenehexanoate Openeye Name: (2,4-dinitrophenyl) 2-isopropylidenehexanoate CAS Name: 2-propan-2-ylidenehexanoic acid (2,4-dinitrophenyl) ester IUPAC Name: (2,4-dinitrophenyl) 2-propan-2-ylidenehexanoate Traditional Name: 2-butyl-3-methyl-but-2-enoic acid (2,4-dinitrophenyl) ester Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(C)C)C(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCC(=C(C)C)C(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O6/c1-4-5-6-12(10(2)3)15(18)23-14-8-7-11(16(19)20)9-13(14)17(21)22/h7-9H,4-6H2,1-3H3