2-[[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methyl]pentanedinitrile

Systemtic Name: 2-[[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methyl]pentanedinitrile Openeye Name: 2-[[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methyl]pentanedinitrile CAS Name: 2-[[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methyl]pentanedinitrile IUPAC Name: 2-[[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methyl]pentanedinitrile Traditional Name: 2-[[4-(4-fluorobenzyl)-1,4-diazepan-1-yl]methyl]glutaronitrile Formula: C18H23FN4 MolecularWeight: 314.400423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC(CCC#N)C#N)CC2=CC=C(C=C2)F

Isomeric SMILES

C1CN(CCN(C1)CC(CCC#N)C#N)CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H23FN4/c19-18-6-4-16(5-7-18)14-22-9-2-10-23(12-11-22)15-17(13-21)3-1-8-20/h4-7,17H,1-3,9-12,14-15H2