6-[3,4-bis[1-[(4-fluorophenyl)methoxy]ethyl]piperazin-1-yl]hexanenitrile

Systemtic Name: 6-[3,4-bis[1-[(4-fluorophenyl)methoxy]ethyl]piperazin-1-yl]hexanenitrile Openeye Name: 6-[3,4-bis[1-[(4-fluorophenyl)methoxy]ethyl]piperazin-1-yl]hexanenitrile CAS Name: 6-[3,4-bis[1-[(4-fluorophenyl)methoxy]ethyl]-1-piperazinyl]hexanenitrile IUPAC Name: 6-[3,4-bis[1-[(4-fluorophenyl)methoxy]ethyl]piperazin-1-yl]hexanenitrile Traditional Name: 6-[3,4-bis[1-(4-fluorobenzyl)oxyethyl]piperazino]hexanenitrile Formula: C28H37F2N3O2 MolecularWeight: 485.609086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CN(CCN1C(C)OCC2=CC=C(C=C2)F)CCCCCC#N)OCC3=CC=C(C=C3)F

Isomeric SMILES

CC(C1CN(CCN1C(C)OCC2=CC=C(C=C2)F)CCCCCC#N)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C28H37F2N3O2/c1-22(34-20-24-7-11-26(29)12-8-24)28-19-32(16-6-4-3-5-15-31)17-18-33(28)23(2)35-21-25-9-13-27(30)14-10-25/h7-14,22-23,28H,3-6,16-21H2,1-2H3