3-oxidanylpropyl 4-ethylcyclohexa-2,4-diene-1-carboxylate

Systemtic Name: 3-oxidanylpropyl 4-ethylcyclohexa-2,4-diene-1-carboxylate Openeye Name: 3-hydroxypropyl 4-ethylcyclohexa-2,4-diene-1-carboxylate CAS Name: 4-ethyl-1-cyclohexa-2,4-dienecarboxylic acid 3-hydroxypropyl ester IUPAC Name: 3-hydroxypropyl 4-ethylcyclohexa-2,4-diene-1-carboxylate Traditional Name: 4-ethylcyclohexa-2,4-diene-1-carboxylic acid 3-hydroxypropyl ester Formula: C12H18O3 MolecularWeight: 210.26952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CCC(C=C1)C(=O)OCCCO

Isomeric SMILES

CCC1=CCC(C=C1)C(=O)OCCCO

InChI

InChI=1S/C12H18O3/c1-2-10-4-6-11(7-5-10)12(14)15-9-3-8-13/h4-6,11,13H,2-3,7-9H2,1H3