3-(3,3-dimethylcyclohexyl)butan-2-yl hydrogen carbonate

Systemtic Name: 3-(3,3-dimethylcyclohexyl)butan-2-yl hydrogen carbonate Openeye Name: [2-(3,3-dimethylcyclohexyl)-1-methyl-propyl] hydrogen carbonate CAS Name: carbonic acid 3-(3,3-dimethylcyclohexyl)butan-2-yl ester IUPAC Name: 3-(3,3-dimethylcyclohexyl)butan-2-yl hydrogen carbonate Traditional Name: carbonic acid [2-(3,3-dimethylcyclohexyl)-1-methyl-propyl] ester Formula: C13H24O3 MolecularWeight: 228.32786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCC(C1)(C)C)C(C)OC(=O)O

Isomeric SMILES

CC(C1CCCC(C1)(C)C)C(C)OC(=O)O

InChI

InChI=1S/C13H24O3/c1-9(10(2)16-12(14)15)11-6-5-7-13(3,4)8-11/h9-11H,5-8H2,1-4H3,(H,14,15)