3-[3-[1-[4-(4-fluorophenyl)phenyl]ethyl]-2-oxidanylidene-7-phenyl-1,3-oxazepan-7-yl]-2,2-dimethyl-propanenitrile

Systemtic Name: 3-[3-[1-[4-(4-fluorophenyl)phenyl]ethyl]-2-oxidanylidene-7-phenyl-1,3-oxazepan-7-yl]-2,2-dimethyl-propanenitrile Openeye Name: 3-[3-[1-[4-(4-fluorophenyl)phenyl]ethyl]-2-oxo-7-phenyl-1,3-oxazepan-7-yl]-2,2-dimethyl-propanenitrile CAS Name: 3-[3-[1-[4-(4-fluorophenyl)phenyl]ethyl]-2-oxo-7-phenyl-1,3-oxazepan-7-yl]-2,2-dimethylpropanenitrile IUPAC Name: 3-[3-[1-[4-(4-fluorophenyl)phenyl]ethyl]-2-oxo-7-phenyl-1,3-oxazepan-7-yl]-2,2-dimethylpropanenitrile Traditional Name: 3-[3-[1-[4-(4-fluorophenyl)phenyl]ethyl]-2-keto-7-phenyl-1,3-oxazepan-7-yl]-2,2-dimethyl-propionitrile Formula: C30H31FN2O2 MolecularWeight: 470.577743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC=C(C=C2)F)N3CCCC(OC3=O)(CC(C)(C)C#N)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=CC=C(C=C2)F)N3CCCC(OC3=O)(CC(C)(C)C#N)C4=CC=CC=C4

InChI

InChI=1S/C30H31FN2O2/c1-22(23-10-12-24(13-11-23)25-14-16-27(31)17-15-25)33-19-7-18-30(35-28(33)34,20-29(2,3)21-32)26-8-5-4-6-9-26/h4-6,8-17,22H,7,18-20H2,1-3H3