2-butyl-3,4,5,6,7-pentadeuterio-1-benzofuran

Systemtic Name: 2-butyl-3,4,5,6,7-pentadeuterio-1-benzofuran Openeye Name: 2-butyl-3,4,5,6,7-pentadeuterio-benzofuran CAS Name: 2-butyl-3,4,5,6,7-pentadeuteriobenzofuran IUPAC Name: 2-butyl-3,4,5,6,7-pentadeuterio-1-benzofuran Traditional Name: 2-butyl-3,4,5,6,7-pentadeuterio-benzofuran Formula: C12H14O MolecularWeight: 179.269769

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2O1

Isomeric SMILES

[2H]C1=C(C(=C2C(=C1[2H])C(=C(O2)CCCC)[2H])[2H])[2H]

InChI

InChI=1S/C12H14O/c1-2-3-7-11-9-10-6-4-5-8-12(10)13-11/h4-6,8-9H,2-3,7H2,1H3/i4D,5D,6D,8D,9D