octan-2-yl cyclohexa-1,5-diene-1-carboxylate

Systemtic Name: octan-2-yl cyclohexa-1,5-diene-1-carboxylate Openeye Name: 1-methylheptyl cyclohexa-1,5-diene-1-carboxylate CAS Name: 1-cyclohexa-1,5-dienecarboxylic acid octan-2-yl ester IUPAC Name: octan-2-yl cyclohexa-1,5-diene-1-carboxylate Traditional Name: cyclohexa-1,5-diene-1-carboxylic acid 1-methylheptyl ester Formula: C15H24O2 MolecularWeight: 236.34986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CCCC=C1

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CCCC=C1

InChI

InChI=1S/C15H24O2/c1-3-4-5-7-10-13(2)17-15(16)14-11-8-6-9-12-14/h8,11-13H,3-7,9-10H2,1-2H3