(3,4-dimethylphenyl) 1,7,7-trimethyl-2-oxidanylidene-3-oxabicyclo[2.2.1]heptane-4-carboxylate

Systemtic Name: (3,4-dimethylphenyl) 1,7,7-trimethyl-2-oxidanylidene-3-oxabicyclo[2.2.1]heptane-4-carboxylate Openeye Name: (3,4-dimethylphenyl) 1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylate CAS Name: 1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylate Traditional Name: 2-keto-1,7,7-trimethyl-3-oxabicyclo[2.2.1]heptane-4-carboxylic acid (3,4-dimethylphenyl) ester Formula: C18H22O4 MolecularWeight: 302.36488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C23CCC(C2(C)C)(C(=O)O3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C23CCC(C2(C)C)(C(=O)O3)C)C

InChI

InChI=1S/C18H22O4/c1-11-6-7-13(10-12(11)2)21-15(20)18-9-8-17(5,14(19)22-18)16(18,3)4/h6-7,10H,8-9H2,1-5H3