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butan-2-yl 2-(2,4-dinitrophenyl)sulfanylethanoate

butan-2-yl 2-(2,4-dinitrophenyl)sulfanylethanoate

Systemtic Name:butan-2-yl 2-(2,4-dinitrophenyl)sulfanylethanoate
Openeye Name:sec-butyl 2-(2,4-dinitrophenyl)sulfanylacetate
CAS Name:2-[(2,4-dinitrophenyl)thio]acetic acid butan-2-yl ester
IUPAC Name:butan-2-yl 2-(2,4-dinitrophenyl)sulfanylacetate
Traditional Name:2-[(2,4-dinitrophenyl)thio]acetic acid sec-butyl ester
Formula: C12H14N2O6S
MolecularWeight: 314.31436
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CSC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CCC(C)OC(=O)CSC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C12H14N2O6S/c1-3-8(2)20-12(15)7-21-11-5-4-9(13(16)17)6-10(11)14(18)19/h4-6,8H,3,7H2,1-2H3


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