4-[[1-(pyridin-2-ylmethyl)pyrrol-2-yl]-pyrrolidin-1-yl-methyl]benzenecarbonitrile

Systemtic Name: 4-[[1-(pyridin-2-ylmethyl)pyrrol-2-yl]-pyrrolidin-1-yl-methyl]benzenecarbonitrile Openeye Name: 4-[[1-(2-pyridylmethyl)pyrrol-2-yl]-pyrrolidin-1-yl-methyl]benzonitrile CAS Name: 4-[[1-(2-pyridinylmethyl)-2-pyrrolyl]-(1-pyrrolidinyl)methyl]benzonitrile IUPAC Name: 4-[[1-(pyridin-2-ylmethyl)pyrrol-2-yl]-pyrrolidin-1-ylmethyl]benzonitrile Traditional Name: 4-[[1-(2-pyridylmethyl)pyrrol-2-yl]-pyrrolidino-methyl]benzonitrile Formula: C22H22N4 MolecularWeight: 342.43688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(C2=CC=C(C=C2)C#N)C3=CC=CN3CC4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)C(C2=CC=C(C=C2)C#N)C3=CC=CN3CC4=CC=CC=N4

InChI

InChI=1S/C22H22N4/c23-16-18-8-10-19(11-9-18)22(25-13-3-4-14-25)21-7-5-15-26(21)17-20-6-1-2-12-24-20/h1-2,5-12,15,22H,3-4,13-14,17H2