4-[3-[4-(2-azanylpropanoyl)piperazin-1-yl]propoxy]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[3-[4-(2-azanylpropanoyl)piperazin-1-yl]propoxy]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-[3-[4-(2-aminopropanoyl)piperazin-1-yl]propoxy]-2-fluoro-benzonitrile CAS Name: 4-[3-[4-(2-amino-1-oxopropyl)-1-piperazinyl]propoxy]-2-fluorobenzonitrile IUPAC Name: 4-[3-[4-(2-aminopropanoyl)piperazin-1-yl]propoxy]-2-fluorobenzonitrile Traditional Name: 4-[3-(4-alanylpiperazino)propoxy]-2-fluoro-benzonitrile Formula: C17H23FN4O2 MolecularWeight: 334.388523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CCCOC2=CC(=C(C=C2)C#N)F)N

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CCCOC2=CC(=C(C=C2)C#N)F)N

InChI

InChI=1S/C17H23FN4O2/c1-13(20)17(23)22-8-6-21(7-9-22)5-2-10-24-15-4-3-14(12-19)16(18)11-15/h3-4,11,13H,2,5-10,20H2,1H3