3-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one Openeye Name: 3-[2-(3,4-dimethylphenyl)-2-oxo-ethyl]-3H-isobenzofuran-1-one CAS Name: 3-[2-(3,4-dimethylphenyl)-2-oxoethyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-(3,4-dimethylphenyl)-2-oxoethyl]-3H-2-benzofuran-1-one Traditional Name: 3-[2-(3,4-dimethylphenyl)-2-keto-ethyl]phthalide Formula: C18H16O3 MolecularWeight: 280.31784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CC2C3=CC=CC=C3C(=O)O2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CC2C3=CC=CC=C3C(=O)O2)C

InChI

InChI=1S/C18H16O3/c1-11-7-8-13(9-12(11)2)16(19)10-17-14-5-3-4-6-15(14)18(20)21-17/h3-9,17H,10H2,1-2H3