N-[3,5-dimethyl-4-(nitromethylsulfanyl)phenyl]ethanamide

Systemtic Name: N-[3,5-dimethyl-4-(nitromethylsulfanyl)phenyl]ethanamide Openeye Name: N-[3,5-dimethyl-4-(nitromethylsulfanyl)phenyl]acetamide CAS Name: N-[3,5-dimethyl-4-(nitromethylthio)phenyl]acetamide IUPAC Name: N-[3,5-dimethyl-4-(nitromethylsulfanyl)phenyl]acetamide Traditional Name: N-[3,5-dimethyl-4-(nitromethylthio)phenyl]acetamide Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1SC[N+](=O)[O-])C)NC(=O)C

Isomeric SMILES

CC1=CC(=CC(=C1SC[N+](=O)[O-])C)NC(=O)C

InChI

InChI=1S/C11H14N2O3S/c1-7-4-10(12-9(3)14)5-8(2)11(7)17-6-13(15)16/h4-5H,6H2,1-3H3,(H,12,14)