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

Systemtic Name: 4-[[3,5-bis(fluoranyl)phenyl]methylamino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[(3,5-difluorophenyl)methylamino]-3-nitro-benzonitrile CAS Name: 4-[(3,5-difluorophenyl)methylamino]-3-nitrobenzonitrile IUPAC Name: 4-[(3,5-difluorophenyl)methylamino]-3-nitrobenzonitrile Traditional Name: 4-[(3,5-difluorobenzyl)amino]-3-nitro-benzonitrile Formula: C14H9F2N3O2 MolecularWeight: 289.236966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)[N+](=O)[O-])NCC2=CC(=CC(=C2)F)F

Isomeric SMILES

C1=CC(=C(C=C1C#N)[N+](=O)[O-])NCC2=CC(=CC(=C2)F)F

InChI

InChI=1S/C14H9F2N3O2/c15-11-3-10(4-12(16)6-11)8-18-13-2-1-9(7-17)5-14(13)19(20)21/h1-6,18H,8H2