(E)-6-[6-methoxy-4-(2-methoxyethoxymethoxy)-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enenitrile

Systemtic Name: (E)-6-[6-methoxy-4-(2-methoxyethoxymethoxy)-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enenitrile Openeye Name: (E)-6-[6-methoxy-4-(2-methoxyethoxymethoxy)-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-hex-4-enenitrile CAS Name: (E)-6-[6-methoxy-4-(2-methoxyethoxymethoxy)-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-4-hexenenitrile IUPAC Name: (E)-6-[6-methoxy-4-(2-methoxyethoxymethoxy)-7-methyl-3-oxo-1H-2-benzofuran-5-yl]-4-methylhex-4-enenitrile Traditional Name: (E)-6-[3-keto-6-methoxy-4-(2-methoxyethoxymethoxy)-7-methyl-phthalan-5-yl]-4-methyl-hex-4-enenitrile Formula: C21H27NO6 MolecularWeight: 391.434722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)OCOCCOC)CC=C(C)CCC#N)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)OCOCCOC)C/C=C(\C)/CC[14C]#N)OC

InChI

InChI=1S/C21H27NO6/c1-14(6-5-9-22)7-8-16-19(25-4)15(2)17-12-27-21(23)18(17)20(16)28-13-26-11-10-24-3/h7H,5-6,8,10-13H2,1-4H3/b14-7+/i9+2