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

Systemtic Name: N-(3-methylsulfanylpropyl)-4-nitro-aniline Openeye Name: N-(3-methylsulfanylpropyl)-4-nitro-aniline CAS Name: N-[3-(methylthio)propyl]-4-nitroaniline IUPAC Name: N-(3-methylsulfanylpropyl)-4-nitroaniline Traditional Name: 3-(methylthio)propyl-(4-nitrophenyl)amine Formula: C10H14N2O2S MolecularWeight: 226.29536

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CSCCCNC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H14N2O2S/c1-15-8-2-7-11-9-3-5-10(6-4-9)12(13)14/h3-6,11H,2,7-8H2,1H3