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4-ethyl-N-(3-methylsulfanylpropyl)-3-nitro-aniline

4-ethyl-N-(3-methylsulfanylpropyl)-3-nitro-aniline

Systemtic Name:4-ethyl-N-(3-methylsulfanylpropyl)-3-nitro-aniline
Openeye Name:4-ethyl-N-(3-methylsulfanylpropyl)-3-nitro-aniline
CAS Name:4-ethyl-N-[3-(methylthio)propyl]-3-nitroaniline
IUPAC Name:4-ethyl-N-(3-methylsulfanylpropyl)-3-nitroaniline
Traditional Name:(4-ethyl-3-nitro-phenyl)-[3-(methylthio)propyl]amine
Formula: C12H18N2O2S
MolecularWeight: 254.34852
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NCCCSC)[N+](=O)[O-]


Isomeric SMILES

CCC1=C(C=C(C=C1)NCCCSC)[N+](=O)[O-]


InChI

InChI=1S/C12H18N2O2S/c1-3-10-5-6-11(9-12(10)14(15)16)13-7-4-8-17-2/h5-6,9,13H,3-4,7-8H2,1-2H3


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