2-pyrrolidin-1-ium-1-ylidenespiro[1,3-thiazolidine-5,10'-anthracene]-4,9'-dione perchlorate

Systemtic Name: 2-pyrrolidin-1-ium-1-ylidenespiro[1,3-thiazolidine-5,10'-anthracene]-4,9'-dione perchlorate Openeye Name: 2'-pyrrolidin-1-ium-1-ylidenespiro[anthracene-10,5'-thiazolidine]-4',9-dione perchlorate CAS Name: 2'-(1-pyrrolidin-1-iumylidene)spiro[anthracene-10,5'-thiazolidine]-4',9-dione perchlorate IUPAC Name: 2-pyrrolidin-1-ium-1-ylidenespiro[1,3-thiazolidine-5,10'-anthracene]-4,9'-dione perchlorate Traditional Name: 2'-pyrrolidin-1-ium-1-ylidenespiro[anthracene-10,5'-thiazolidine]-4',9-quinone perchlorate Formula: C20H17ClN2O6S MolecularWeight: 448.87678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=C2NC(=O)C3(S2)C4=CC=CC=C4C(=O)C5=CC=CC=C35)C1.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1CC[N+](=C2NC(=O)C3(S2)C4=CC=CC=C4C(=O)C5=CC=CC=C35)C1.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H16N2O2S.ClHO4/c23-17-13-7-1-3-9-15(13)20(16-10-4-2-8-14(16)17)18(24)21-19(25-20)22-11-5-6-12-22;2-1(3,4)5/h1-4,7-10H,5-6,11-12H2;(H,2,3,4,5)