(E)-4-methyl-2-(7-methyl-2-benzofuran-5-yl)-3-oxidanylidene-hex-4-enoic acid

Systemtic Name: (E)-4-methyl-2-(7-methyl-2-benzofuran-5-yl)-3-oxidanylidene-hex-4-enoic acid Openeye Name: (E)-4-methyl-2-(7-methylisobenzofuran-5-yl)-3-oxo-hex-4-enoic acid CAS Name: (E)-4-methyl-2-(7-methyl-5-isobenzofuranyl)-3-oxo-4-hexenoic acid IUPAC Name: (E)-4-methyl-2-(7-methyl-2-benzofuran-5-yl)-3-oxohex-4-enoic acid Traditional Name: (E)-3-keto-4-methyl-2-(7-methylisobenzofuran-5-yl)hex-4-enoic acid Formula: C16H16O4 MolecularWeight: 272.29584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(=O)C(C1=CC2=COC=C2C(=C1)C)C(=O)O

Isomeric SMILES

C/C=C(\C)/C(=O)C(C1=CC2=COC=C2C(=C1)C)C(=O)O

InChI

InChI=1S/C16H16O4/c1-4-9(2)15(17)14(16(18)19)11-5-10(3)13-8-20-7-12(13)6-11/h4-8,14H,1-3H3,(H,18,19)/b9-4+