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

Systemtic Name: (Z)-6-(4-cyano-7-methyl-3-oxidanylidene-6-prop-2-enyl-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid Openeye Name: (Z)-6-(6-allyl-4-cyano-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid CAS Name: (Z)-6-(4-cyano-7-methyl-3-oxo-6-prop-2-enyl-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid IUPAC Name: (Z)-6-(4-cyano-7-methyl-3-oxo-6-prop-2-enyl-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid Traditional Name: (Z)-6-(6-allyl-4-cyano-3-keto-7-methyl-phthalan-5-yl)-4-methyl-hex-4-enoic acid Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2COC(=O)C2=C(C(=C1CC=C)CC=C(C)CCC(=O)O)C#N

Isomeric SMILES

CC1=C2COC(=O)C2=C(C(=C1CC=C)C/C=C(/C)\CCC(=O)O)C#N

InChI

InChI=1S/C20H21NO4/c1-4-5-14-13(3)17-11-25-20(24)19(17)16(10-21)15(14)8-6-12(2)7-9-18(22)23/h4,6H,1,5,7-9,11H2,2-3H3,(H,22,23)/b12-6-