(2-butan-2-yl-4,6-dinitro-phenyl) butylsulfanylmethanoate

Systemtic Name: (2-butan-2-yl-4,6-dinitro-phenyl) butylsulfanylmethanoate Openeye Name: (2,4-dinitro-6-sec-butyl-phenyl) butylsulfanylformate CAS Name: (butylthio)formic acid (2-butan-2-yl-4,6-dinitrophenyl) ester IUPAC Name: (2-butan-2-yl-4,6-dinitrophenyl) butylsulfanylformate Traditional Name: (butylthio)formic acid (2,4-dinitro-6-sec-butyl-phenyl) ester Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=O)OC1=C(C=C(C=C1C(C)CC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCSC(=O)OC1=C(C=C(C=C1C(C)CC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O6S/c1-4-6-7-24-15(18)23-14-12(10(3)5-2)8-11(16(19)20)9-13(14)17(21)22/h8-10H,4-7H2,1-3H3