(3E)-3-(3,3-dimethyl-2-oxidanylidene-butylidene)-2-benzofuran-1-one

Systemtic Name: (3E)-3-(3,3-dimethyl-2-oxidanylidene-butylidene)-2-benzofuran-1-one Openeye Name: (3E)-3-(3,3-dimethyl-2-oxo-butylidene)isobenzofuran-1-one CAS Name: (3E)-3-(3,3-dimethyl-2-oxobutylidene)-1-isobenzofuranone IUPAC Name: (3E)-3-(3,3-dimethyl-2-oxobutylidene)-2-benzofuran-1-one Traditional Name: (3E)-3-(2-keto-3,3-dimethyl-butylidene)phthalide Formula: C14H14O3 MolecularWeight: 230.25916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C=C1C2=CC=CC=C2C(=O)O1

Isomeric SMILES

CC(C)(C)C(=O)/C=C/1\C2=CC=CC=C2C(=O)O1

InChI

InChI=1S/C14H14O3/c1-14(2,3)12(15)8-11-9-6-4-5-7-10(9)13(16)17-11/h4-8H,1-3H3/b11-8+