4-[2-[[2-(trifluoromethyloxy)phenyl]methyl]-1,2-diazepan-1-yl]naphthalene-1-carbonitrile

Systemtic Name: 4-[2-[[2-(trifluoromethyloxy)phenyl]methyl]-1,2-diazepan-1-yl]naphthalene-1-carbonitrile Openeye Name: 4-[2-[[2-(trifluoromethoxy)phenyl]methyl]diazepan-1-yl]naphthalene-1-carbonitrile CAS Name: 4-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1-diazepanyl]-1-naphthalenecarbonitrile IUPAC Name: 4-[2-[[2-(trifluoromethoxy)phenyl]methyl]diazepan-1-yl]naphthalene-1-carbonitrile Traditional Name: 4-[2-[2-(trifluoromethoxy)benzyl]diazepan-1-yl]naphthalene-1-carbonitrile Formula: C24H22F3N3O MolecularWeight: 425.44619

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(N(CC1)C2=CC=C(C3=CC=CC=C32)C#N)CC4=CC=CC=C4OC(F)(F)F

Isomeric SMILES

C1CCN(N(CC1)C2=CC=C(C3=CC=CC=C32)C#N)CC4=CC=CC=C4OC(F)(F)F

InChI

InChI=1S/C24H22F3N3O/c25-24(26,27)31-23-11-5-2-8-19(23)17-29-14-6-1-7-15-30(29)22-13-12-18(16-28)20-9-3-4-10-21(20)22/h2-5,8-13H,1,6-7,14-15,17H2