1-[(3Z)-3-(2-chloranylthioxanthen-9-ylidene)propyl]pyrrolidine; sulfuric acid

Systemtic Name: 1-[(3Z)-3-(2-chloranylthioxanthen-9-ylidene)propyl]pyrrolidine; sulfuric acid Openeye Name: 1-[(3Z)-3-(2-chlorothioxanthen-9-ylidene)propyl]pyrrolidine; sulfuric acid CAS Name: 1-[(3Z)-3-(2-chloro-9-thioxanthenylidene)propyl]pyrrolidine; sulfuric acid IUPAC Name: 1-[(3Z)-3-(2-chlorothioxanthen-9-ylidene)propyl]pyrrolidine; sulfuric acid Traditional Name: 1-[(3Z)-3-(2-chlorothioxanthen-9-ylidene)propyl]pyrrolidine; sulfuric acid Formula: C20H22ClNO4S2 MolecularWeight: 439.97598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.OS(=O)(=O)O

Isomeric SMILES

C1CCN(C1)CC/C=C\2/C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.OS(=O)(=O)O

InChI

InChI=1S/C20H20ClNS.H2O4S/c21-15-9-10-20-18(14-15)16(7-5-13-22-11-3-4-12-22)17-6-1-2-8-19(17)23-20;1-5(2,3)4/h1-2,6-10,14H,3-5,11-13H2;(H2,1,2,3,4)/b16-7-;