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S-ethyl 4-methyl-2-nitro-benzenecarbothioate

S-ethyl 4-methyl-2-nitro-benzenecarbothioate

Systemtic Name:S-ethyl 4-methyl-2-nitro-benzenecarbothioate
Openeye Name:S-ethyl 4-methyl-2-nitro-benzenecarbothioate
CAS Name:4-methyl-2-nitrobenzenecarbothioic acid S-ethyl ester
IUPAC Name:S-ethyl 4-methyl-2-nitrobenzenecarbothioate
Traditional Name:4-methyl-2-nitro-thiobenzoic acid S-ethyl ester
Formula: C10H11NO3S
MolecularWeight: 225.26424
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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C1=C(C=C(C=C1)C)[N+](=O)[O-]


Isomeric SMILES

CCSC(=O)C1=C(C=C(C=C1)C)[N+](=O)[O-]


InChI

InChI=1S/C10H11NO3S/c1-3-15-10(12)8-5-4-7(2)6-9(8)11(13)14/h4-6H,3H2,1-2H3


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