1-(furan-2-ylmethyl)-4,5-diphenyl-2-(pyrrolidin-1-ium-1-ylidenemethylamino)pyrrole-3-carbonitrile

Systemtic Name: 1-(furan-2-ylmethyl)-4,5-diphenyl-2-(pyrrolidin-1-ium-1-ylidenemethylamino)pyrrole-3-carbonitrile Openeye Name: 1-(2-furylmethyl)-4,5-diphenyl-2-(pyrrolidin-1-ium-1-ylidenemethylamino)pyrrole-3-carbonitrile CAS Name: 1-(2-furanylmethyl)-4,5-diphenyl-2-(1-pyrrolidin-1-iumylidenemethylamino)-3-pyrrolecarbonitrile IUPAC Name: 1-(furan-2-ylmethyl)-4,5-diphenyl-2-(pyrrolidin-1-ium-1-ylidenemethylamino)pyrrole-3-carbonitrile Traditional Name: 1-(2-furfuryl)-4,5-diphenyl-2-(pyrrolidin-1-ium-1-ylidenemethylamino)pyrrole-3-carbonitrile Formula: C27H25N4O+ MolecularWeight: 421.5136

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=CNC2=C(C(=C(N2CC3=CC=CO3)C4=CC=CC=C4)C5=CC=CC=C5)C#N)C1

Isomeric SMILES

C1CC[N+](=CNC2=C(C(=C(N2CC3=CC=CO3)C4=CC=CC=C4)C5=CC=CC=C5)C#N)C1

InChI

InChI=1S/C27H24N4O/c28-18-24-25(21-10-3-1-4-11-21)26(22-12-5-2-6-13-22)31(19-23-14-9-17-32-23)27(24)29-20-30-15-7-8-16-30/h1-6,9-14,17,20H,7-8,15-16,19H2/p+1