N-[2-[4-[bis(fluoranyl)methoxy]phenyl]ethyl]-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-[2-[4-[bis(fluoranyl)methoxy]phenyl]ethyl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-[2-[4-(difluoromethoxy)phenyl]ethyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[2-[4-(difluoromethoxy)phenyl]ethyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[2-[4-(difluoromethoxy)phenyl]ethyl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-[2-[4-(difluoromethoxy)phenyl]ethyl]-4-(methylthio)-3-nitro-benzamide Formula: C17H16F2N2O4S MolecularWeight: 382.381746

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NCCC2=CC=C(C=C2)OC(F)F)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NCCC2=CC=C(C=C2)OC(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H16F2N2O4S/c1-26-15-7-4-12(10-14(15)21(23)24)16(22)20-9-8-11-2-5-13(6-3-11)25-17(18)19/h2-7,10,17H,8-9H2,1H3,(H,20,22)