(3R,8S)-3-methoxycarbonyl-2-methylidene-8-oxidanyl-nonanoic acid

Systemtic Name: (3R,8S)-3-methoxycarbonyl-2-methylidene-8-oxidanyl-nonanoic acid Openeye Name: (3R,8S)-8-hydroxy-3-methoxycarbonyl-2-methylene-nonanoic acid CAS Name: (3R,8S)-8-hydroxy-3-methoxycarbonyl-2-methylenenonanoic acid IUPAC Name: (3R,8S)-8-hydroxy-3-methoxycarbonyl-2-methylidenenonanoic acid Traditional Name: 2-[(1R,6S)-1-carbomethoxy-6-hydroxy-heptyl]acrylic acid Formula: C12H20O5 MolecularWeight: 244.2842

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCC(C(=C)C(=O)O)C(=O)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C12H20O5/c1-8(13)6-4-5-7-10(12(16)17-3)9(2)11(14)15/h8,10,13H,2,4-7H2,1,3H3,(H,14,15)/t8-,10+/m0/s1