4-(2,5-dimethylpiperazin-1-yl)-2-(fluoranylmethyl)benzenecarbonitrile

Systemtic Name: 4-(2,5-dimethylpiperazin-1-yl)-2-(fluoranylmethyl)benzenecarbonitrile Openeye Name: 4-(2,5-dimethylpiperazin-1-yl)-2-(fluoromethyl)benzonitrile CAS Name: 4-(2,5-dimethyl-1-piperazinyl)-2-(fluoromethyl)benzonitrile IUPAC Name: 4-(2,5-dimethylpiperazin-1-yl)-2-(fluoromethyl)benzonitrile Traditional Name: 4-(2,5-dimethylpiperazino)-2-(fluoromethyl)benzonitrile Formula: C14H18FN3 MolecularWeight: 247.311223

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNC(CN1C2=CC(=C(C=C2)C#N)CF)C

Isomeric SMILES

CC1CNC(CN1C2=CC(=C(C=C2)C#N)CF)C

InChI

InChI=1S/C14H18FN3/c1-10-9-18(11(2)8-17-10)14-4-3-12(7-16)13(5-14)6-15/h3-5,10-11,17H,6,8-9H2,1-2H3