5-[2-[2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]phenoxy]pentanenitrile

Systemtic Name: 5-[2-[2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]phenoxy]pentanenitrile Openeye Name: 5-[2-[2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]phenoxy]pentanenitrile CAS Name: 5-[2-[2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]phenoxy]pentanenitrile IUPAC Name: 5-[2-[2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]phenoxy]pentanenitrile Traditional Name: 5-[2-[2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]phenoxy]valeronitrile Formula: C24H28N2O2 MolecularWeight: 376.49132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1C2=CC=CC=C2OCCCCC#N)CCCC3=CC=CC=C3

Isomeric SMILES

C1CN(C(=O)C1C2=CC=CC=C2OCCCCC#N)CCCC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O2/c25-16-7-2-8-19-28-23-14-6-5-13-21(23)22-15-18-26(24(22)27)17-9-12-20-10-3-1-4-11-20/h1,3-6,10-11,13-14,22H,2,7-9,12,15,17-19H2