2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]ethanol

Systemtic Name: 2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]ethanol Openeye Name: 2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]ethanol CAS Name: 2-[(2-methyl-3-nitrophenyl)methylthio]ethanol IUPAC Name: 2-[(2-methyl-3-nitrophenyl)methylsulfanyl]ethanol Traditional Name: 2-[(2-methyl-3-nitro-benzyl)thio]ethanol Formula: C10H13NO3S MolecularWeight: 227.28012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CSCCO

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CSCCO

InChI

InChI=1S/C10H13NO3S/c1-8-9(7-15-6-5-12)3-2-4-10(8)11(13)14/h2-4,12H,5-7H2,1H3