N-[3-[2,2-bis(fluoranyl)ethoxy]-5-nitro-phenyl]-3-naphthalen-2-ylsulfonyl-propanamide

Systemtic Name: N-[3-[2,2-bis(fluoranyl)ethoxy]-5-nitro-phenyl]-3-naphthalen-2-ylsulfonyl-propanamide Openeye Name: N-[3-(2,2-difluoroethoxy)-5-nitro-phenyl]-3-(2-naphthylsulfonyl)propanamide CAS Name: N-[3-(2,2-difluoroethoxy)-5-nitrophenyl]-3-(2-naphthalenylsulfonyl)propanamide IUPAC Name: N-[3-(2,2-difluoroethoxy)-5-nitrophenyl]-3-naphthalen-2-ylsulfonylpropanamide Traditional Name: N-[3-(2,2-difluoroethoxy)-5-nitro-phenyl]-3-(2-naphthylsulfonyl)propionamide Formula: C21H18F2N2O6S MolecularWeight: 464.439226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)CCC(=O)NC3=CC(=CC(=C3)OCC(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)CCC(=O)NC3=CC(=CC(=C3)OCC(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H18F2N2O6S/c22-20(23)13-31-18-11-16(10-17(12-18)25(27)28)24-21(26)7-8-32(29,30)19-6-5-14-3-1-2-4-15(14)9-19/h1-6,9-12,20H,7-8,13H2,(H,24,26)