5-bromanyl-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-fluoranyl-benzamide

Systemtic Name: 5-bromanyl-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-fluoranyl-benzamide Openeye Name: 5-bromo-N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]-2-fluoro-benzamide CAS Name: 5-bromo-N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-2-fluorobenzamide IUPAC Name: 5-bromo-N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-2-fluorobenzamide Traditional Name: 5-bromo-N-(2-ethoxy-5-piperidinosulfonyl-phenyl)-2-fluoro-benzamide Formula: C20H22BrFN2O4S MolecularWeight: 485.367083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C=CC(=C3)Br)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C20H22BrFN2O4S/c1-2-28-19-9-7-15(29(26,27)24-10-4-3-5-11-24)13-18(19)23-20(25)16-12-14(21)6-8-17(16)22/h6-9,12-13H,2-5,10-11H2,1H3,(H,23,25)