2-morpholin-4-ylethyl (Z)-6-[6-methoxy-7-methyl-4-(2-methylpropanoyloxy)-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoate hydrochloride

Systemtic Name: 2-morpholin-4-ylethyl (Z)-6-[6-methoxy-7-methyl-4-(2-methylpropanoyloxy)-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoate hydrochloride Openeye Name: 2-morpholinoethyl (Z)-6-[6-methoxy-7-methyl-4-(2-methylpropanoyloxy)-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-hex-4-enoate hydrochloride CAS Name: (Z)-6-[6-methoxy-7-methyl-4-(2-methyl-1-oxopropoxy)-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-4-hexenoic acid 2-(4-morpholinyl)ethyl ester hydrochloride IUPAC Name: 2-morpholin-4-ylethyl (Z)-6-[6-methoxy-7-methyl-4-(2-methylpropanoyloxy)-3-oxo-1H-2-benzofuran-5-yl]-4-methylhex-4-enoate hydrochloride Traditional Name: (Z)-6-(4-isobutyryloxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-4-methyl-hex-4-enoic acid 2-morpholinoethyl ester hydrochloride Formula: C27H38ClNO8 MolecularWeight: 540.04552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)OC(=O)C(C)C)CC=C(C)CCC(=O)OCCN3CCOCC3)OC.Cl

Isomeric SMILES

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

InChI

InChI=1S/C27H37NO8.ClH/c1-17(2)26(30)36-25-20(24(32-5)19(4)21-16-35-27(31)23(21)25)8-6-18(3)7-9-22(29)34-15-12-28-10-13-33-14-11-28;/h6,17H,7-16H2,1-5H3;1H/b18-6-;