4-[4-[[2-oxidanylidene-1-(4-phenylbutyl)pyrrolidin-3-yl]methoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[[2-oxidanylidene-1-(4-phenylbutyl)pyrrolidin-3-yl]methoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[[2-oxo-1-(4-phenylbutyl)pyrrolidin-3-yl]methoxy]phenyl]benzonitrile CAS Name: 4-[4-[[2-oxo-1-(4-phenylbutyl)-3-pyrrolidinyl]methoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[[2-oxo-1-(4-phenylbutyl)pyrrolidin-3-yl]methoxy]phenyl]benzonitrile Traditional Name: 4-[4-[[2-keto-1-(4-phenylbutyl)pyrrolidin-3-yl]methoxy]phenyl]benzonitrile Formula: C28H28N2O2 MolecularWeight: 424.53412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)CCCCC4=CC=CC=C4

Isomeric SMILES

C1CN(C(=O)C1COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)CCCCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O2/c29-20-23-9-11-24(12-10-23)25-13-15-27(16-14-25)32-21-26-17-19-30(28(26)31)18-5-4-8-22-6-2-1-3-7-22/h1-3,6-7,9-16,26H,4-5,8,17-19,21H2