ethyl 3-acetyloxy-4-methylidene-cyclohexane-1-carboxylate; 1,3,5-trimethylbenzene

Systemtic Name: ethyl 3-acetyloxy-4-methylidene-cyclohexane-1-carboxylate; 1,3,5-trimethylbenzene Openeye Name: ethyl 3-acetoxy-4-methylene-cyclohexanecarboxylate; mesitylene CAS Name: 3-acetyloxy-4-methylene-1-cyclohexanecarboxylic acid ethyl ester; 1,3,5-trimethylbenzene IUPAC Name: ethyl 3-acetyloxy-4-methylidenecyclohexane-1-carboxylate; 1,3,5-trimethylbenzene Traditional Name: 3-acetoxy-4-methylene-cyclohexanecarboxylic acid ethyl ester; mesitylene Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(=C)C(C1)OC(=O)C.CC1=CC(=CC(=C1)C)C

Isomeric SMILES

CCOC(=O)C1CCC(=C)C(C1)OC(=O)C.CC1=CC(=CC(=C1)C)C

InChI

InChI=1S/C12H18O4.C9H12/c1-4-15-12(14)10-6-5-8(2)11(7-10)16-9(3)13;1-7-4-8(2)6-9(3)5-7/h10-11H,2,4-7H2,1,3H3;4-6H,1-3H3