(1S,8aS)-1-methyl-1-oxidanyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulen-4-one

Systemtic Name: (1S,8aS)-1-methyl-1-oxidanyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulen-4-one Openeye Name: (1S,8aS)-1-hydroxy-7-isopropyl-1-methyl-2,3,3a,5,6,8a-hexahydroazulen-4-one CAS Name: (1S,8aS)-1-hydroxy-1-methyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulen-4-one IUPAC Name: (1S,8aS)-1-hydroxy-1-methyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulen-4-one Traditional Name: (1S,8aS)-1-hydroxy-7-isopropyl-1-methyl-2,3,3a,5,6,8a-hexahydroazulen-4-one Formula: C14H22O2 MolecularWeight: 222.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2C(CCC2(C)O)C(=O)CC1

Isomeric SMILES

CC(C)C1=C[C@H]2C(CC[C@]2(C)O)C(=O)CC1

InChI

InChI=1S/C14H22O2/c1-9(2)10-4-5-13(15)11-6-7-14(3,16)12(11)8-10/h8-9,11-12,16H,4-7H2,1-3H3/t11?,12-,14-/m0/s1