4-[2-[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]propylamino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[2-[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]propylamino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[2-[1-(difluoromethyl)benzimidazol-2-yl]propylamino]-3-nitro-benzonitrile CAS Name: 4-[2-[1-(difluoromethyl)-2-benzimidazolyl]propylamino]-3-nitrobenzonitrile IUPAC Name: 4-[2-[1-(difluoromethyl)benzimidazol-2-yl]propylamino]-3-nitrobenzonitrile Traditional Name: 4-[2-[1-(difluoromethyl)benzimidazol-2-yl]propylamino]-3-nitro-benzonitrile Formula: C18H15F2N5O2 MolecularWeight: 371.340806

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C(C=C(C=C1)C#N)[N+](=O)[O-])C2=NC3=CC=CC=C3N2C(F)F

Isomeric SMILES

CC(CNC1=C(C=C(C=C1)C#N)[N+](=O)[O-])C2=NC3=CC=CC=C3N2C(F)F

InChI

InChI=1S/C18H15F2N5O2/c1-11(10-22-13-7-6-12(9-21)8-16(13)25(26)27)17-23-14-4-2-3-5-15(14)24(17)18(19)20/h2-8,11,18,22H,10H2,1H3