4-[4-[3-[(2R,5R)-2,5-dimethylpyrrolidin-1-yl]propoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[3-[(2R,5R)-2,5-dimethylpyrrolidin-1-yl]propoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[3-[(2R,5R)-2,5-dimethylpyrrolidin-1-yl]propoxy]phenyl]benzonitrile CAS Name: 4-[4-[3-[(2R,5R)-2,5-dimethyl-1-pyrrolidinyl]propoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[3-[(2R,5R)-2,5-dimethylpyrrolidin-1-yl]propoxy]phenyl]benzonitrile Traditional Name: 4-[4-[3-[(2R,5R)-2,5-dimethylpyrrolidino]propoxy]phenyl]benzonitrile Formula: C22H26N2O MolecularWeight: 334.45464

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(N1CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)C

Isomeric SMILES

C[C@@H]1CC[C@H](N1CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C22H26N2O/c1-17-4-5-18(2)24(17)14-3-15-25-22-12-10-21(11-13-22)20-8-6-19(16-23)7-9-20/h6-13,17-18H,3-5,14-15H2,1-2H3/t17-,18-/m1/s1