2-fluoranyl-6-[4-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoyl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoyl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-[2-(2-isopropyl-5-methyl-phenoxy)acetyl]piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-[2-(5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-[2-(2-isopropyl-5-methyl-phenoxy)acetyl]piperazino]benzonitrile Formula: C23H26FN3O2 MolecularWeight: 395.469843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N2CCN(CC2)C3=C(C(=CC=C3)F)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N2CCN(CC2)C3=C(C(=CC=C3)F)C#N

InChI

InChI=1S/C23H26FN3O2/c1-16(2)18-8-7-17(3)13-22(18)29-15-23(28)27-11-9-26(10-12-27)21-6-4-5-20(24)19(21)14-25/h4-8,13,16H,9-12,15H2,1-3H3