2-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methylamino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methylamino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[[4-(difluoromethoxy)-3-methoxy-phenyl]methylamino]-5-nitro-benzonitrile CAS Name: 2-[[4-(difluoromethoxy)-3-methoxyphenyl]methylamino]-5-nitrobenzonitrile IUPAC Name: 2-[[4-(difluoromethoxy)-3-methoxyphenyl]methylamino]-5-nitrobenzonitrile Traditional Name: 2-[[4-(difluoromethoxy)-3-methoxy-benzyl]amino]-5-nitro-benzonitrile Formula: C16H13F2N3O4 MolecularWeight: 349.288926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N)OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N)OC(F)F

InChI

InChI=1S/C16H13F2N3O4/c1-24-15-6-10(2-5-14(15)25-16(17)18)9-20-13-4-3-12(21(22)23)7-11(13)8-19/h2-7,16,20H,9H2,1H3