(3S,6R)-6-butyl-3-phenyl-3-prop-2-enyl-1,4-dioxane-2,5-dione

Systemtic Name: (3S,6R)-6-butyl-3-phenyl-3-prop-2-enyl-1,4-dioxane-2,5-dione Openeye Name: (3S,6R)-3-allyl-6-butyl-3-phenyl-1,4-dioxane-2,5-dione CAS Name: (3S,6R)-6-butyl-3-phenyl-3-prop-2-enyl-1,4-dioxane-2,5-dione IUPAC Name: (3S,6R)-6-butyl-3-phenyl-3-prop-2-enyl-1,4-dioxane-2,5-dione Traditional Name: (3S,6R)-3-allyl-6-butyl-3-phenyl-1,4-dioxane-2,5-quinone Formula: C17H20O4 MolecularWeight: 288.3383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)OC(C(=O)O1)(CC=C)C2=CC=CC=C2

Isomeric SMILES

CCCC[C@@H]1C(=O)O[C@@](C(=O)O1)(CC=C)C2=CC=CC=C2

InChI

InChI=1S/C17H20O4/c1-3-5-11-14-15(18)21-17(12-4-2,16(19)20-14)13-9-7-6-8-10-13/h4,6-10,14H,2-3,5,11-12H2,1H3/t14-,17+/m1/s1