methyl 4,6,6-trimethylcyclohexa-1,3-diene-1-carboxylate

Systemtic Name: methyl 4,6,6-trimethylcyclohexa-1,3-diene-1-carboxylate Openeye Name: methyl 4,6,6-trimethylcyclohexa-1,3-diene-1-carboxylate CAS Name: 4,6,6-trimethyl-1-cyclohexa-1,3-dienecarboxylic acid methyl ester IUPAC Name: methyl 4,6,6-trimethylcyclohexa-1,3-diene-1-carboxylate Traditional Name: 4,6,6-trimethylcyclohexa-1,3-diene-1-carboxylic acid methyl ester Formula: C11H16O2 MolecularWeight: 180.24354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16O2/c1-8-5-6-9(10(12)13-4)11(2,3)7-8/h5-6H,7H2,1-4H3