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

Systemtic Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-methoxy-2-phenyl-ethanamide Openeye Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-methoxy-2-phenyl-acetamide CAS Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-methoxy-2-phenylacetamide IUPAC Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-methoxy-2-phenylacetamide Traditional Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-methoxy-2-phenyl-acetamide Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NC(=O)C(C2=CC=CC=C2)OC

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NC(=O)C(C2=CC=CC=C2)OC

InChI

InChI=1S/C18H20N2O6S/c1-12-9-15(10-13(2)17(12)27(24,25)11-20(22)23)19-18(21)16(26-3)14-7-5-4-6-8-14/h4-10,16H,11H2,1-3H3,(H,19,21)