2-[[4-[bis(fluoranyl)methoxy]phenyl]methyl-methyl-amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[[4-[bis(fluoranyl)methoxy]phenyl]methyl-methyl-amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[[4-(difluoromethoxy)phenyl]methyl-methyl-amino]-5-nitro-benzonitrile CAS Name: 2-[[4-(difluoromethoxy)phenyl]methyl-methylamino]-5-nitrobenzonitrile IUPAC Name: 2-[[4-(difluoromethoxy)phenyl]methyl-methylamino]-5-nitrobenzonitrile Traditional Name: 2-[[4-(difluoromethoxy)benzyl]-methyl-amino]-5-nitro-benzonitrile Formula: C16H13F2N3O3 MolecularWeight: 333.289526

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OC(F)F)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CN(CC1=CC=C(C=C1)OC(F)F)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H13F2N3O3/c1-20(10-11-2-5-14(6-3-11)24-16(17)18)15-7-4-13(21(22)23)8-12(15)9-19/h2-8,16H,10H2,1H3