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

Systemtic Name: (Z)-6-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-2-(2-morpholin-4-ylethyl)hex-4-enoate hydrochloride Openeye Name: (Z)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-2-(2-morpholinoethyl)hex-4-enoate hydrochloride CAS Name: (Z)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-2-[2-(4-morpholinyl)ethyl]-4-hexenoate hydrochloride IUPAC Name: (Z)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methyl-2-(2-morpholin-4-ylethyl)hex-4-enoate hydrochloride Traditional Name: (Z)-6-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-4-methyl-2-(2-morpholinoethyl)hex-4-enoate hydrochloride Formula: C23H31ClNO7- MolecularWeight: 468.94774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CC(CCN3CCOCC3)C(=O)[O-])OC.Cl

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(/C)\CC(CCN3CCOCC3)C(=O)[O-])OC.Cl

InChI

InChI=1S/C23H31NO7.ClH/c1-14(12-16(22(26)27)6-7-24-8-10-30-11-9-24)4-5-17-20(25)19-18(13-31-23(19)28)15(2)21(17)29-3;/h4,16,25H,5-13H2,1-3H3,(H,26,27);1H/p-1/b14-4-;