5-cinnamylidene-3-(piperidin-1-ium-1-ylmethyl)-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-cinnamylidene-3-(piperidin-1-ium-1-ylmethyl)-1,3-thiazolidine-2,4-dione Openeye Name: 5-cinnamylidene-3-(piperidin-1-ium-1-ylmethyl)thiazolidine-2,4-dione CAS Name: 5-cinnamylidene-3-(1-piperidin-1-iumylmethyl)thiazolidine-2,4-dione IUPAC Name: 5-cinnamylidene-3-(piperidin-1-ium-1-ylmethyl)-1,3-thiazolidine-2,4-dione Traditional Name: 5-cinnamylidene-3-(piperidin-1-ium-1-ylmethyl)thiazolidine-2,4-quinone Formula: C18H21N2O2S+ MolecularWeight: 329.43654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O2S/c21-17-16(11-7-10-15-8-3-1-4-9-15)23-18(22)20(17)14-19-12-5-2-6-13-19/h1,3-4,7-11H,2,5-6,12-14H2/p+1