2-[1-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]oxybenzenecarbonitrile

Systemtic Name: 2-[1-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]oxybenzenecarbonitrile Openeye Name: 2-[2-[4-(5-chloro-2-fluoro-benzoyl)piperazin-1-yl]-1-methyl-2-oxo-ethoxy]benzonitrile CAS Name: 2-[1-[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-1-oxopropan-2-yl]oxybenzonitrile IUPAC Name: 2-[1-[4-(5-chloro-2-fluorobenzoyl)piperazin-1-yl]-1-oxopropan-2-yl]oxybenzonitrile Traditional Name: 2-[2-[4-(5-chloro-2-fluoro-benzoyl)piperazino]-2-keto-1-methyl-ethoxy]benzonitrile Formula: C21H19ClFN3O3 MolecularWeight: 415.845263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)Cl)F)OC3=CC=CC=C3C#N

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)Cl)F)OC3=CC=CC=C3C#N

InChI

InChI=1S/C21H19ClFN3O3/c1-14(29-19-5-3-2-4-15(19)13-24)20(27)25-8-10-26(11-9-25)21(28)17-12-16(22)6-7-18(17)23/h2-7,12,14H,8-11H2,1H3