(2Z)-6-oxidanyl-7-(piperidin-1-ium-1-ylmethyl)-2-(thiophen-2-ylmethylidene)-1-benzofuran-3-one

Systemtic Name: (2Z)-6-oxidanyl-7-(piperidin-1-ium-1-ylmethyl)-2-(thiophen-2-ylmethylidene)-1-benzofuran-3-one Openeye Name: (2Z)-6-hydroxy-7-(piperidin-1-ium-1-ylmethyl)-2-(2-thienylmethylene)benzofuran-3-one CAS Name: (2Z)-6-hydroxy-7-(1-piperidin-1-iumylmethyl)-2-(thiophen-2-ylmethylidene)-3-benzofuranone IUPAC Name: (2Z)-6-hydroxy-7-(piperidin-1-ium-1-ylmethyl)-2-(thiophen-2-ylmethylidene)-1-benzofuran-3-one Traditional Name: (2Z)-6-hydroxy-7-(piperidin-1-ium-1-ylmethyl)-2-(2-thenylidene)coumaran-3-one Formula: C19H20NO3S+ MolecularWeight: 342.432

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=C(C=CC3=C2OC(=CC4=CC=CS4)C3=O)O

Isomeric SMILES

C1CC[NH+](CC1)CC2=C(C=CC3=C2O/C(=C\C4=CC=CS4)/C3=O)O

InChI

InChI=1S/C19H19NO3S/c21-16-7-6-14-18(22)17(11-13-5-4-10-24-13)23-19(14)15(16)12-20-8-2-1-3-9-20/h4-7,10-11,21H,1-3,8-9,12H2/p+1/b17-11-