3-ethanoyl-1,2,3,4,4a,5,8,8a-octahydronaphthalene-2-carboxylic acid

Systemtic Name: 3-ethanoyl-1,2,3,4,4a,5,8,8a-octahydronaphthalene-2-carboxylic acid Openeye Name: 3-acetyl-1,2,3,4,4a,5,8,8a-octahydronaphthalene-2-carboxylic acid CAS Name: 3-acetyl-1,2,3,4,4a,5,8,8a-octahydronaphthalene-2-carboxylic acid IUPAC Name: 3-acetyl-1,2,3,4,4a,5,8,8a-octahydronaphthalene-2-carboxylic acid Traditional Name: 3-acetyl-1,2,3,4,4a,5,8,8a-octahydronaphthalene-2-carboxylic acid Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC2CC=CCC2CC1C(=O)O

Isomeric SMILES

CC(=O)C1CC2CC=CCC2CC1C(=O)O

InChI

InChI=1S/C13H18O3/c1-8(14)11-6-9-4-2-3-5-10(9)7-12(11)13(15)16/h2-3,9-12H,4-7H2,1H3,(H,15,16)