N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-iodanyl-ethanamide

Systemtic Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-iodanyl-ethanamide Openeye Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-iodo-acetamide CAS Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-iodoacetamide IUPAC Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-iodoacetamide Traditional Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-iodo-acetamide Formula: C11H13IN2O5S MolecularWeight: 412.20079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NC(=O)CI

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NC(=O)CI

InChI

InChI=1S/C11H13IN2O5S/c1-7-3-9(13-10(15)5-12)4-8(2)11(7)20(18,19)6-14(16)17/h3-4H,5-6H2,1-2H3,(H,13,15)