[(2S,3S,3aR)-3-acetyloxy-6-butyl-5-oxidanylidene-2,3,3a,4-tetrahydro-1H-pentalen-2-yl] ethanoate

Systemtic Name: [(2S,3S,3aR)-3-acetyloxy-6-butyl-5-oxidanylidene-2,3,3a,4-tetrahydro-1H-pentalen-2-yl] ethanoate Openeye Name: [(2S,3S,3aR)-3-acetoxy-6-butyl-5-oxo-2,3,3a,4-tetrahydro-1H-pentalen-2-yl] acetate CAS Name: acetic acid [(2S,3S,3aR)-3-acetyloxy-6-butyl-5-oxo-2,3,3a,4-tetrahydro-1H-pentalen-2-yl] ester IUPAC Name: [(2S,3S,3aR)-3-acetyloxy-6-butyl-5-oxo-2,3,3a,4-tetrahydro-1H-pentalen-2-yl] acetate Traditional Name: acetic acid [(2S,3S,3aR)-3-acetoxy-6-butyl-5-keto-2,3,3a,4-tetrahydro-1H-pentalen-2-yl] ester Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2CC(C(C2CC1=O)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCC1=C2C[C@@H]([C@H]([C@@H]2CC1=O)OC(=O)C)OC(=O)C

InChI

InChI=1S/C16H22O5/c1-4-5-6-11-12-8-15(20-9(2)17)16(21-10(3)18)13(12)7-14(11)19/h13,15-16H,4-8H2,1-3H3/t13-,15+,16+/m1/s1