(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(piperidin-1-ium-1-ylmethyl)-1,3-thiazolidine-2,4-dione

Systemtic Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(piperidin-1-ium-1-ylmethyl)-1,3-thiazolidine-2,4-dione Openeye Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylene)-3-(piperidin-1-ium-1-ylmethyl)thiazolidine-2,4-dione CAS Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(1-piperidin-1-iumylmethyl)thiazolidine-2,4-dione IUPAC Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(piperidin-1-ium-1-ylmethyl)-1,3-thiazolidine-2,4-dione Traditional Name: (5Z)-3-(piperidin-1-ium-1-ylmethyl)-5-piperonylidene-thiazolidine-2,4-quinone Formula: C17H19N2O4S+ MolecularWeight: 347.40876

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=O

Isomeric SMILES

C1CC[NH+](CC1)CN2C(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/SC2=O

InChI

InChI=1S/C17H18N2O4S/c20-16-15(9-12-4-5-13-14(8-12)23-11-22-13)24-17(21)19(16)10-18-6-2-1-3-7-18/h4-5,8-9H,1-3,6-7,10-11H2/p+1/b15-9-