(2S,5S)-2-methyl-5-propan-2-yl-hexanedioate

Systemtic Name: (2S,5S)-2-methyl-5-propan-2-yl-hexanedioate Openeye Name: (2S,5S)-2-isopropyl-5-methyl-hexanedioate CAS Name: (2S,5S)-2-methyl-5-propan-2-ylhexanedioate IUPAC Name: (2S,5S)-2-methyl-5-propan-2-ylhexanedioate Traditional Name: (2S,5S)-2-isopropyl-5-methyl-adipate Formula: C10H16O4-2 MolecularWeight: 200.23164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC(C)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C[C@@H](CC[C@@H](C(C)C)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C10H18O4/c1-6(2)8(10(13)14)5-4-7(3)9(11)12/h6-8H,4-5H2,1-3H3,(H,11,12)(H,13,14)/p-2/t7-,8-/m0/s1