dimethyl 4-(3-methyl-3-oxidanyl-but-1-ynyl)benzene-1,2-dicarboxylate

Systemtic Name: dimethyl 4-(3-methyl-3-oxidanyl-but-1-ynyl)benzene-1,2-dicarboxylate Openeye Name: dimethyl 4-(3-hydroxy-3-methyl-but-1-ynyl)benzene-1,2-dicarboxylate CAS Name: 4-(3-hydroxy-3-methylbut-1-ynyl)benzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzene-1,2-dicarboxylate Traditional Name: 4-(3-hydroxy-3-methyl-but-1-ynyl)benzene-1,2-dicarboxylic acid dimethyl ester Formula: C15H16O5 MolecularWeight: 276.28454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC(=C(C=C1)C(=O)OC)C(=O)OC)O

Isomeric SMILES

CC(C)(C#CC1=CC(=C(C=C1)C(=O)OC)C(=O)OC)O

InChI

InChI=1S/C15H16O5/c1-15(2,18)8-7-10-5-6-11(13(16)19-3)12(9-10)14(17)20-4/h5-6,9,18H,1-4H3