4-[4-[3-[3-(dimethylamino)pyrrolidin-1-yl]propoxy]phenyl]-2-iodanyl-benzenecarbonitrile

Systemtic Name: 4-[4-[3-[3-(dimethylamino)pyrrolidin-1-yl]propoxy]phenyl]-2-iodanyl-benzenecarbonitrile Openeye Name: 4-[4-[3-[3-(dimethylamino)pyrrolidin-1-yl]propoxy]phenyl]-2-iodo-benzonitrile CAS Name: 4-[4-[3-[3-(dimethylamino)-1-pyrrolidinyl]propoxy]phenyl]-2-iodobenzonitrile IUPAC Name: 4-[4-[3-[3-(dimethylamino)pyrrolidin-1-yl]propoxy]phenyl]-2-iodobenzonitrile Traditional Name: 4-[4-[3-[3-(dimethylamino)pyrrolidino]propoxy]phenyl]-2-iodo-benzonitrile Formula: C22H26IN3O MolecularWeight: 475.36581

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(C1)CCCOC2=CC=C(C=C2)C3=CC(=C(C=C3)C#N)I

Isomeric SMILES

CN(C)C1CCN(C1)CCCOC2=CC=C(C=C2)C3=CC(=C(C=C3)C#N)I

InChI

InChI=1S/C22H26IN3O/c1-25(2)20-10-12-26(16-20)11-3-13-27-21-8-6-17(7-9-21)18-4-5-19(15-24)22(23)14-18/h4-9,14,20H,3,10-13,16H2,1-2H3