N-(6-ethanoyl-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)sulfonyl-propanamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)sulfonyl-propanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)sulfonyl-propanamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)sulfonylpropanamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)sulfonylpropanamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)sulfonyl-propionamide Formula: C18H16FNO6S MolecularWeight: 393.386143

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)F)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)F)OCO2

InChI

InChI=1S/C18H16FNO6S/c1-11(21)14-8-16-17(26-10-25-16)9-15(14)20-18(22)6-7-27(23,24)13-4-2-12(19)3-5-13/h2-5,8-9H,6-7,10H2,1H3,(H,20,22)