6-phenethyl-6-propyl-oxane-2,4-dione

Systemtic Name: 6-phenethyl-6-propyl-oxane-2,4-dione Openeye Name: 6-phenethyl-6-propyl-tetrahydropyran-2,4-dione CAS Name: 6-phenethyl-6-propyloxane-2,4-dione IUPAC Name: 6-phenethyl-6-propyloxane-2,4-dione Traditional Name: 6-phenethyl-6-propyl-tetrahydropyran-2,4-quinone Formula: C16H20O3 MolecularWeight: 260.3282

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(=O)CC(=O)O1)CCC2=CC=CC=C2

Isomeric SMILES

CCCC1(CC(=O)CC(=O)O1)CCC2=CC=CC=C2

InChI

InChI=1S/C16H20O3/c1-2-9-16(12-14(17)11-15(18)19-16)10-8-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3