(1S,2aS,8bS)-1-butyl-2a-(phenylcarbonyl)-2,8b-dihydro-1H-cyclobuta[c]chromen-3-one

Systemtic Name: (1S,2aS,8bS)-1-butyl-2a-(phenylcarbonyl)-2,8b-dihydro-1H-cyclobuta[c]chromen-3-one Openeye Name: (1S,2aS,8bS)-2a-benzoyl-1-butyl-2,8b-dihydro-1H-cyclobuta[c]chromen-3-one CAS Name: (1S,2aS,8bS)-2a-benzoyl-1-butyl-2,8b-dihydro-1H-cyclobuta[c][1]benzopyran-3-one IUPAC Name: (1S,2aS,8bS)-2a-benzoyl-1-butyl-2,8b-dihydro-1H-cyclobuta[c]chromen-3-one Traditional Name: (1S,2aS,8bS)-2a-benzoyl-1-butyl-2,8b-dihydro-1H-cyclobuta[c]chromen-3-one Formula: C22H22O3 MolecularWeight: 334.40828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC2(C1C3=CC=CC=C3OC2=O)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCCC[C@H]1C[C@]2([C@@H]1C3=CC=CC=C3OC2=O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22O3/c1-2-3-9-16-14-22(20(23)15-10-5-4-6-11-15)19(16)17-12-7-8-13-18(17)25-21(22)24/h4-8,10-13,16,19H,2-3,9,14H2,1H3/t16-,19-,22-/m0/s1