3-(4-bromophenyl)-8-pyrrolidin-1-ium-1-ylidene-thieno[2,3-b]pyrrolizine chloride

Systemtic Name: 3-(4-bromophenyl)-8-pyrrolidin-1-ium-1-ylidene-thieno[2,3-b]pyrrolizine chloride Openeye Name: 3-(4-bromophenyl)-8-pyrrolidin-1-ium-1-ylidene-thieno[2,3-b]pyrrolizine chloride CAS Name: 3-(4-bromophenyl)-8-(1-pyrrolidin-1-iumylidene)thieno[2,3-b]pyrrolizine chloride IUPAC Name: 3-(4-bromophenyl)-8-pyrrolidin-1-ium-1-ylidenethieno[2,3-b]pyrrolizine chloride Traditional Name: 3-(4-bromophenyl)-8-pyrrolidin-1-ium-1-ylidene-thieno[2,3-b]pyrrolizine chloride Formula: C19H16BrClN2S MolecularWeight: 419.76574

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=C2C3=CC=CN3C4=C2SC=C4C5=CC=C(C=C5)Br)C1.[Cl-]

Isomeric SMILES

C1CC[N+](=C2C3=CC=CN3C4=C2SC=C4C5=CC=C(C=C5)Br)C1.[Cl-]

InChI

InChI=1S/C19H16BrN2S.ClH/c20-14-7-5-13(6-8-14)15-12-23-19-17(15)22-11-3-4-16(22)18(19)21-9-1-2-10-21;/h3-8,11-12H,1-2,9-10H2;1H/q+1;/p-1