(1S,3S)-5-methylcyclohexane-1,3-dicarboxylate

Systemtic Name: (1S,3S)-5-methylcyclohexane-1,3-dicarboxylate Openeye Name: (1S,3S)-5-methylcyclohexane-1,3-dicarboxylate CAS Name: (1S,3S)-5-methylcyclohexane-1,3-dicarboxylate IUPAC Name: (1S,3S)-5-methylcyclohexane-1,3-dicarboxylate Traditional Name: (1S,3S)-5-methylcyclohexane-1,3-dicarboxylate Formula: C9H12O4-2 MolecularWeight: 184.18918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1C[C@@H](C[C@H](C1)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C9H14O4/c1-5-2-6(8(10)11)4-7(3-5)9(12)13/h5-7H,2-4H2,1H3,(H,10,11)(H,12,13)/p-2/t6-,7-/m0/s1