6-(4-fluoranylphenoxy)-5-oxidanylidene-2-phenyl-7-piperazin-1-yl-2-propan-2-yl-heptanenitrile

Systemtic Name: 6-(4-fluoranylphenoxy)-5-oxidanylidene-2-phenyl-7-piperazin-1-yl-2-propan-2-yl-heptanenitrile Openeye Name: 6-(4-fluorophenoxy)-2-isopropyl-5-oxo-2-phenyl-7-piperazin-1-yl-heptanenitrile CAS Name: 6-(4-fluorophenoxy)-5-oxo-2-phenyl-7-(1-piperazinyl)-2-propan-2-ylheptanenitrile IUPAC Name: 6-(4-fluorophenoxy)-5-oxo-2-phenyl-7-piperazin-1-yl-2-propan-2-ylheptanenitrile Traditional Name: 6-(4-fluorophenoxy)-2-isopropyl-5-keto-2-phenyl-7-piperazino-enanthonitrile Formula: C26H32FN3O2 MolecularWeight: 437.549583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC(=O)C(CN1CCNCC1)OC2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCC(=O)C(CN1CCNCC1)OC2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C26H32FN3O2/c1-20(2)26(19-28,21-6-4-3-5-7-21)13-12-24(31)25(18-30-16-14-29-15-17-30)32-23-10-8-22(27)9-11-23/h3-11,20,25,29H,12-18H2,1-2H3