5-(4,4-dimethyl-3-methylidene-pent-1-ynyl)-2-benzofuran-1,3-dione

Systemtic Name: 5-(4,4-dimethyl-3-methylidene-pent-1-ynyl)-2-benzofuran-1,3-dione Openeye Name: 5-(4,4-dimethyl-3-methylene-pent-1-ynyl)isobenzofuran-1,3-dione CAS Name: 5-(4,4-dimethyl-3-methylenepent-1-ynyl)isobenzofuran-1,3-dione IUPAC Name: 5-(4,4-dimethyl-3-methylidenepent-1-ynyl)-2-benzofuran-1,3-dione Traditional Name: 5-(3-tert-butylbut-3-en-1-ynyl)phthalan-1,3-quinone Formula: C16H14O3 MolecularWeight: 254.28056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=C)C#CC1=CC2=C(C=C1)C(=O)OC2=O

Isomeric SMILES

CC(C)(C)C(=C)C#CC1=CC2=C(C=C1)C(=O)OC2=O

InChI

InChI=1S/C16H14O3/c1-10(16(2,3)4)5-6-11-7-8-12-13(9-11)15(18)19-14(12)17/h7-9H,1H2,2-4H3