2-[(1R,3aS,6aS)-1,3a,6a-trimethyl-5,6-dihydro-4H-pentalen-1-yl]ethanoic acid

Systemtic Name: 2-[(1R,3aS,6aS)-1,3a,6a-trimethyl-5,6-dihydro-4H-pentalen-1-yl]ethanoic acid Openeye Name: 2-[(1R,3aS,6aS)-1,3a,6a-trimethyl-5,6-dihydro-4H-pentalen-1-yl]acetic acid CAS Name: 2-[(1R,3aS,6aS)-1,3a,6a-trimethyl-5,6-dihydro-4H-pentalen-1-yl]acetic acid IUPAC Name: 2-[(1R,3aS,6aS)-1,3a,6a-trimethyl-5,6-dihydro-4H-pentalen-1-yl]acetic acid Traditional Name: 2-[(1R,3aS,6aS)-1,3a,6a-trimethyl-5,6-dihydro-4H-pentalen-1-yl]acetic acid Formula: C13H20O2 MolecularWeight: 208.2967

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCCC1(C(C=C2)(C)CC(=O)O)C

Isomeric SMILES

C[C@@]12CCC[C@@]1([C@](C=C2)(C)CC(=O)O)C

InChI

InChI=1S/C13H20O2/c1-11-5-4-6-13(11,3)12(2,8-7-11)9-10(14)15/h7-8H,4-6,9H2,1-3H3,(H,14,15)/t11-,12-,13-/m0/s1