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

Systemtic Name: 1-morpholin-4-ylethyl (Z)-6-(6-methoxy-7-methyl-3-oxidanylidene-4-propanoyloxy-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoate hydrochloride Openeye Name: 1-morpholinoethyl (Z)-6-(6-methoxy-7-methyl-3-oxo-4-propanoyloxy-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoate hydrochloride CAS Name: (Z)-6-[6-methoxy-7-methyl-3-oxo-4-(1-oxopropoxy)-1H-isobenzofuran-5-yl]-4-methyl-4-hexenoic acid 1-(4-morpholinyl)ethyl ester hydrochloride IUPAC Name: 1-morpholin-4-ylethyl (Z)-6-(6-methoxy-7-methyl-3-oxo-4-propanoyloxy-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate hydrochloride Traditional Name: (Z)-6-(3-keto-6-methoxy-7-methyl-4-propionyloxy-phthalan-5-yl)-4-methyl-hex-4-enoic acid 1-morpholinoethyl ester hydrochloride Formula: C26H36ClNO8 MolecularWeight: 526.01894

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C(=C(C2=C1C(=O)OC2)C)OC)CC=C(C)CCC(=O)OC(C)N3CCOCC3.Cl

Isomeric SMILES

CCC(=O)OC1=C(C(=C(C2=C1C(=O)OC2)C)OC)C/C=C(/C)\CCC(=O)OC(C)N3CCOCC3.Cl

InChI

InChI=1S/C26H35NO8.ClH/c1-6-21(28)35-25-19(24(31-5)17(3)20-15-33-26(30)23(20)25)9-7-16(2)8-10-22(29)34-18(4)27-11-13-32-14-12-27;/h7,18H,6,8-15H2,1-5H3;1H/b16-7-;