(3E)-3-[2-[6-methoxy-7-methyl-4-(methylamino)-3-oxidanylidene-1H-2-benzofuran-5-yl]ethylidene]cyclopentane-1-carbothioate

Systemtic Name: (3E)-3-[2-[6-methoxy-7-methyl-4-(methylamino)-3-oxidanylidene-1H-2-benzofuran-5-yl]ethylidene]cyclopentane-1-carbothioate Openeye Name: (3E)-3-[2-[6-methoxy-7-methyl-4-(methylamino)-3-oxo-1H-isobenzofuran-5-yl]ethylidene]cyclopentanecarbothioate CAS Name: (3E)-3-[2-[6-methoxy-7-methyl-4-(methylamino)-3-oxo-1H-isobenzofuran-5-yl]ethylidene]-1-cyclopentanecarbothioate IUPAC Name: (3E)-3-[2-[6-methoxy-7-methyl-4-(methylamino)-3-oxo-1H-2-benzofuran-5-yl]ethylidene]cyclopentane-1-carbothioate Traditional Name: (3E)-3-[2-[3-keto-6-methoxy-7-methyl-4-(methylamino)phthalan-5-yl]ethylidene]cyclopentanecarbothioate Formula: C19H22NO4S- MolecularWeight: 360.44728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)NC)CC=C3CCC(C3)C(=S)[O-])OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)NC)C/C=C/3\CCC(C3)C(=S)[O-])OC

InChI

InChI=1S/C19H23NO4S/c1-10-14-9-24-18(21)15(14)16(20-2)13(17(10)23-3)7-5-11-4-6-12(8-11)19(22)25/h5,12,20H,4,6-9H2,1-3H3,(H,22,25)/p-1/b11-5+