ethyl (2E)-2-(1H-isochromen-1-ylmethylidene)-5,5-dimethyl-4-oxidanylidene-hexanoate

Systemtic Name: ethyl (2E)-2-(1H-isochromen-1-ylmethylidene)-5,5-dimethyl-4-oxidanylidene-hexanoate Openeye Name: ethyl (2E)-2-(1H-isochromen-1-ylmethylene)-5,5-dimethyl-4-oxo-hexanoate CAS Name: (2E)-2-(1H-2-benzopyran-1-ylmethylidene)-5,5-dimethyl-4-oxohexanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-(1H-isochromen-1-ylmethylidene)-5,5-dimethyl-4-oxohexanoate Traditional Name: (E)-3-(1H-isochromen-1-yl)-2-(2-keto-3,3-dimethyl-butyl)acrylic acid ethyl ester Formula: C20H24O4 MolecularWeight: 328.40216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1C2=CC=CC=C2C=CO1)CC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)/C(=C/C1C2=CC=CC=C2C=CO1)/CC(=O)C(C)(C)C

InChI

InChI=1S/C20H24O4/c1-5-23-19(22)15(13-18(21)20(2,3)4)12-17-16-9-7-6-8-14(16)10-11-24-17/h6-12,17H,5,13H2,1-4H3/b15-12+