(2R,5R)-2,5-bis(2-chlorophenyl)pyrrolidin-1-ium-3,3,4,4-tetracarbonitrile

Systemtic Name: (2R,5R)-2,5-bis(2-chlorophenyl)pyrrolidin-1-ium-3,3,4,4-tetracarbonitrile Openeye Name: (2R,5R)-2,5-bis(2-chlorophenyl)pyrrolidin-1-ium-3,3,4,4-tetracarbonitrile CAS Name: (2R,5R)-2,5-bis(2-chlorophenyl)pyrrolidin-1-ium-3,3,4,4-tetracarbonitrile IUPAC Name: (2R,5R)-2,5-bis(2-chlorophenyl)pyrrolidin-1-ium-3,3,4,4-tetracarbonitrile Traditional Name: (2R,5R)-2,5-bis(2-chlorophenyl)pyrrolidin-1-ium-3,3,4,4-tetracarbonitrile Formula: C20H12Cl2N5+ MolecularWeight: 393.24878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2C(C(C([NH2+]2)C3=CC=CC=C3Cl)(C#N)C#N)(C#N)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)[C@H]2C(C([C@@H]([NH2+]2)C3=CC=CC=C3Cl)(C#N)C#N)(C#N)C#N)Cl

InChI

InChI=1S/C20H11Cl2N5/c21-15-7-3-1-5-13(15)17-19(9-23,10-24)20(11-25,12-26)18(27-17)14-6-2-4-8-16(14)22/h1-8,17-18,27H/p+1/t17-,18-/m0/s1