(3S)-2-methylidene-3-[(5S)-5-oxidanylhexyl]butanedioate

Systemtic Name: (3S)-2-methylidene-3-[(5S)-5-oxidanylhexyl]butanedioate Openeye Name: (2S)-2-[(5S)-5-hydroxyhexyl]-3-methylene-butanedioate CAS Name: (2S)-2-[(5S)-5-hydroxyhexyl]-3-methylenebutanedioate IUPAC Name: (2S)-2-[(5S)-5-hydroxyhexyl]-3-methylidenebutanedioate Traditional Name: (2S)-2-[(5S)-5-hydroxyhexyl]-3-methylene-succinate Formula: C11H16O5-2 MolecularWeight: 228.24174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H18O5/c1-7(12)5-3-4-6-9(11(15)16)8(2)10(13)14/h7,9,12H,2-6H2,1H3,(H,13,14)(H,15,16)/p-2/t7-,9-/m0/s1