4-[4-[3-(3-methyl-3-oxidanyl-pyrrolidin-1-yl)propoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[3-(3-methyl-3-oxidanyl-pyrrolidin-1-yl)propoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[3-(3-hydroxy-3-methyl-pyrrolidin-1-yl)propoxy]phenyl]benzonitrile CAS Name: 4-[4-[3-(3-hydroxy-3-methyl-1-pyrrolidinyl)propoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[3-(3-hydroxy-3-methylpyrrolidin-1-yl)propoxy]phenyl]benzonitrile Traditional Name: 4-[4-[3-(3-hydroxy-3-methyl-pyrrolidino)propoxy]phenyl]benzonitrile Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)O

Isomeric SMILES

CC1(CCN(C1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C21H24N2O2/c1-21(24)11-13-23(16-21)12-2-14-25-20-9-7-19(8-10-20)18-5-3-17(15-22)4-6-18/h3-10,24H,2,11-14,16H2,1H3