4-propoxy-3-propyl-cyclohexa-3,5-diene-1,2-dione

Systemtic Name: 4-propoxy-3-propyl-cyclohexa-3,5-diene-1,2-dione Openeye Name: 4-propoxy-3-propyl-1,2-benzoquinone CAS Name: 4-propoxy-3-propylcyclohexa-3,5-diene-1,2-dione IUPAC Name: 4-propoxy-3-propylcyclohexa-3,5-diene-1,2-dione Traditional Name: 4-propoxy-3-propyl-o-benzoquinone Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=O)C1=O)OCCC

Isomeric SMILES

CCCC1=C(C=CC(=O)C1=O)OCCC

InChI

InChI=1S/C12H16O3/c1-3-5-9-11(15-8-4-2)7-6-10(13)12(9)14/h6-7H,3-5,8H2,1-2H3