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

Systemtic Name: (1S,2aS,8bS)-2a-(2-methylpropanoyl)-1-phenyl-2,8b-dihydro-1H-cyclobuta[c]chromen-3-one Openeye Name: (1S,2aS,8bS)-2a-(2-methylpropanoyl)-1-phenyl-2,8b-dihydro-1H-cyclobuta[c]chromen-3-one CAS Name: (1S,2aS,8bS)-2a-(2-methyl-1-oxopropyl)-1-phenyl-2,8b-dihydro-1H-cyclobuta[c][1]benzopyran-3-one IUPAC Name: (1S,2aS,8bS)-2a-(2-methylpropanoyl)-1-phenyl-2,8b-dihydro-1H-cyclobuta[c]chromen-3-one Traditional Name: (1S,2aS,8bS)-2a-isobutyryl-1-phenyl-2,8b-dihydro-1H-cyclobuta[c]chromen-3-one Formula: C21H20O3 MolecularWeight: 320.3817

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C12CC(C1C3=CC=CC=C3OC2=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(=O)[C@]12C[C@@H]([C@H]1C3=CC=CC=C3OC2=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20O3/c1-13(2)19(22)21-12-16(14-8-4-3-5-9-14)18(21)15-10-6-7-11-17(15)24-20(21)23/h3-11,13,16,18H,12H2,1-2H3/t16-,18-,21+/m1/s1