3-[3,4-bis(fluoranyl)phenyl]-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: 3-[3,4-bis(fluoranyl)phenyl]-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: 3-(3,4-difluorophenyl)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)propanamide CAS Name: 3-(3,4-difluorophenyl)-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(3,4-difluorophenyl)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-(3,4-difluorophenyl)-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)propionamide Formula: C21H24F2N2O4S MolecularWeight: 438.488066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CCC2=CC(=C(C=C2)F)F)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CCC2=CC(=C(C=C2)F)F)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H24F2N2O4S/c1-2-29-19-9-7-16(14-20(19)30(27,28)25-11-3-4-12-25)24-21(26)10-6-15-5-8-17(22)18(23)13-15/h5,7-9,13-14H,2-4,6,10-12H2,1H3,(H,24,26)