| 2D Structure | |
| CID | 5352899 |
| Target | / , IMA1 |
| IUPAC Name | (3E)-3-butylidene-2-benzofuran-1-one |
| InChI | InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8+ |
| InChI Key | WMBOCUXXNSOQHM-DHZHZOJOSA-N |
| Canonical SMILES | CCCC=C1C2=CC=CC=C2C(=O)O1 |
| Isomeric SMILES | CCC/C=C/1\C2=CC=CC=C2C(=O)O1 |
| Molecular Formula | C12H12O2 |
| Molecular Weight | 188.22 |
| synonyms | ['Ligusticum lactone', 'Butylidenephthalide', 'Butylidene phthalide', '3-Butylidene-1(3H)-isobenzofuranone', 'n-Butylidene phthalide', 'Phthalide, 3-butylidene-', 'EINECS 208-991-3', 'NSC 325307', '3-Butylidene phthalide', 'AI3-37306', 'S9178G4B3F', '(3E)-3-butylidene-1,3-dihydro-2-benzofuran-1-one', '3-n-Butylidene-phthalide', '3-BUTYLIDENEPHTHALIDE [FHFI]', '208-991-3', '(3E)-3-butylidene-2-benzofuran-1-one', '(E)-3-Butylidenephthalide', '3-Butylidenephthalide, (E)-', '76681-73-7', 'CHEMBL1765390', '(Z)-3-Butylidenephthalide', 'FEMA No. 3333', '3-Butylidenephthalide, (Z)-', 'Lingustilide', 'UNII-S9178G4B3F', '3-Butylidene-phthalide', 'cis-Butylidenephthalide;(Z)-Butylidenephthalide', '2JL3MHX6ZE', '3-Butylidenephthalide, 8CI', '1(3H)-Isobenzofuranone, 3-butylidene-, (3E)-', 'SCHEMBL290483', 'SCHEMBL783051', 'FEMA 3333', 'CHEBI:196485', 'WMBOCUXXNSOQHM-DHZHZOJOSA-N', 'BDBM50341204', '(3E)-3-butylideneisobenzofuran-1-one', 'AKOS032948974', '(3E)-3-butylidene-2-benzouran-1-one', '(E)-3-Butylideneisobenzofuran-1(3H)-one', 'Q27890207'] |
From Pubchem