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methyl 3,5-dinitro-2-[(4-nitrophenyl)methylsulfanyl]benzoate

methyl 3,5-dinitro-2-[(4-nitrophenyl)methylsulfanyl]benzoate

Systemtic Name:methyl 3,5-dinitro-2-[(4-nitrophenyl)methylsulfanyl]benzoate
Openeye Name:methyl 3,5-dinitro-2-[(4-nitrophenyl)methylsulfanyl]benzoate
CAS Name:3,5-dinitro-2-[(4-nitrophenyl)methylthio]benzoic acid methyl ester
IUPAC Name:methyl 3,5-dinitro-2-[(4-nitrophenyl)methylsulfanyl]benzoate
Traditional Name:3,5-dinitro-2-[(4-nitrobenzyl)thio]benzoic acid methyl ester
Formula: C15H11N3O8S
MolecularWeight: 393.32814
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1SCC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

COC(=O)C1=CC(=CC(=C1SCC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C15H11N3O8S/c1-26-15(19)12-6-11(17(22)23)7-13(18(24)25)14(12)27-8-9-2-4-10(5-3-9)16(20)21/h2-7H,8H2,1H3


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