1-[2-(nitromethylsulfanyl)phenyl]ethanol

Systemtic Name: 1-[2-(nitromethylsulfanyl)phenyl]ethanol Openeye Name: 1-[2-(nitromethylsulfanyl)phenyl]ethanol CAS Name: 1-[2-(nitromethylthio)phenyl]ethanol IUPAC Name: 1-[2-(nitromethylsulfanyl)phenyl]ethanol Traditional Name: 1-[2-(nitromethylthio)phenyl]ethanol Formula: C9H11NO3S MolecularWeight: 213.25354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1SC[N+](=O)[O-])O

Isomeric SMILES

CC(C1=CC=CC=C1SC[N+](=O)[O-])O

InChI

InChI=1S/C9H11NO3S/c1-7(11)8-4-2-3-5-9(8)14-6-10(12)13/h2-5,7,11H,6H2,1H3