(Z)-6-(4-cyano-6-ethyl-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid

Systemtic Name: (Z)-6-(4-cyano-6-ethyl-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid Openeye Name: (Z)-6-(4-cyano-6-ethyl-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid CAS Name: (Z)-6-(4-cyano-6-ethyl-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid IUPAC Name: (Z)-6-(4-cyano-6-ethyl-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid Traditional Name: (Z)-6-(4-cyano-6-ethyl-3-keto-7-methyl-phthalan-5-yl)-4-methyl-hex-4-enoic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1C)COC2=O)C#N)CC=C(C)CCC(=O)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1C)COC2=O)C#N)C/C=C(/C)\CCC(=O)O

InChI

InChI=1S/C19H21NO4/c1-4-13-12(3)16-10-24-19(23)18(16)15(9-20)14(13)7-5-11(2)6-8-17(21)22/h5H,4,6-8,10H2,1-3H3,(H,21,22)/b11-5-