(3S,8aR)-3-tert-butyl-8a-methyl-2,3-dihydroazulen-1-one

Systemtic Name: (3S,8aR)-3-tert-butyl-8a-methyl-2,3-dihydroazulen-1-one Openeye Name: (3S,8aR)-3-tert-butyl-8a-methyl-2,3-dihydroazulen-1-one CAS Name: (3S,8aR)-3-tert-butyl-8a-methyl-2,3-dihydroazulen-1-one IUPAC Name: (3S,8aR)-3-tert-butyl-8a-methyl-2,3-dihydroazulen-1-one Traditional Name: (3S,8aR)-3-tert-butyl-8a-methyl-2,3-dihydroazulen-1-one Formula: C15H20O MolecularWeight: 216.3187

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Descriptors Computed from Structure

Canonical SMILES:

CC12C=CC=CC=C1C(CC2=O)C(C)(C)C

Isomeric SMILES

C[C@@]12C=CC=CC=C1[C@@H](CC2=O)C(C)(C)C

InChI

InChI=1S/C15H20O/c1-14(2,3)12-10-13(16)15(4)9-7-5-6-8-11(12)15/h5-9,12H,10H2,1-4H3/t12-,15-/m1/s1