(2E)-2-[2-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)ethylidene]cyclopentane-1-carbothioic S-acid

Systemtic Name: (2E)-2-[2-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)ethylidene]cyclopentane-1-carbothioic S-acid Openeye Name: (2E)-2-[2-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)ethylidene]cyclopentanecarbothioic S-acid CAS Name: (2E)-2-[2-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)ethylidene]-1-cyclopentanecarbothioic S-acid IUPAC Name: (2E)-2-[2-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)ethylidene]cyclopentane-1-carbothioic S-acid Traditional Name: (2E)-2-[2-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)ethylidene]cyclopentanecarbothioic S-acid Formula: C18H20O5S MolecularWeight: 348.4134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC=C3CCCC3C(=O)S)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)C/C=C/3\CCCC3C(=O)S)OC

InChI

InChI=1S/C18H20O5S/c1-9-13-8-23-17(20)14(13)15(19)12(16(9)22-2)7-6-10-4-3-5-11(10)18(21)24/h6,11,19H,3-5,7-8H2,1-2H3,(H,21,24)/b10-6+