(1S,3aR,8aR)-1,4,4-trimethyl-8-methylidene-3,3a,5,6,7,8a-hexahydro-1H-azulen-2-one

Systemtic Name: (1S,3aR,8aR)-1,4,4-trimethyl-8-methylidene-3,3a,5,6,7,8a-hexahydro-1H-azulen-2-one Openeye Name: (1S,3aR,8aR)-1,4,4-trimethyl-8-methylene-3,3a,5,6,7,8a-hexahydro-1H-azulen-2-one CAS Name: (1S,3aR,8aR)-1,4,4-trimethyl-8-methylene-3,3a,5,6,7,8a-hexahydro-1H-azulen-2-one IUPAC Name: (1S,3aR,8aR)-1,4,4-trimethyl-8-methylidene-3,3a,5,6,7,8a-hexahydro-1H-azulen-2-one Traditional Name: (1S,3aR,8aR)-1,4,4-trimethyl-8-methylene-3,3a,5,6,7,8a-hexahydro-1H-azulen-2-one Formula: C14H22O MolecularWeight: 206.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(CC1=O)C(CCCC2=C)(C)C

Isomeric SMILES

C[C@H]1[C@H]2[C@@H](CC1=O)C(CCCC2=C)(C)C

InChI

InChI=1S/C14H22O/c1-9-6-5-7-14(3,4)11-8-12(15)10(2)13(9)11/h10-11,13H,1,5-8H2,2-4H3/t10-,11-,13+/m1/s1