2-morpholin-4-ylethyl (E)-4-methyl-6-[7-methyl-4,6-bis(oxidanyl)-3-oxidanylidene-1H-2-benzofuran-5-yl]hex-4-enoate

Systemtic Name: 2-morpholin-4-ylethyl (E)-4-methyl-6-[7-methyl-4,6-bis(oxidanyl)-3-oxidanylidene-1H-2-benzofuran-5-yl]hex-4-enoate Openeye Name: 2-morpholinoethyl (E)-6-(4,6-dihydroxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoate CAS Name: (E)-6-(4,6-dihydroxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl (E)-6-(4,6-dihydroxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate Traditional Name: (E)-6-(4,6-dihydroxy-3-keto-7-methyl-phthalan-5-yl)-4-methyl-hex-4-enoic acid 2-morpholinoethyl ester Formula: C22H29NO7 MolecularWeight: 419.46816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)OCCN3CCOCC3)O

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(\C)/CCC(=O)OCCN3CCOCC3)O

InChI

InChI=1S/C22H29NO7/c1-14(4-6-18(24)29-12-9-23-7-10-28-11-8-23)3-5-16-20(25)15(2)17-13-30-22(27)19(17)21(16)26/h3,25-26H,4-13H2,1-2H3/b14-3+