(2S)-2-(1-adamantyl)-3-oxidanyl-3-oxidanylidene-propanoate

Systemtic Name: (2S)-2-(1-adamantyl)-3-oxidanyl-3-oxidanylidene-propanoate Openeye Name: (2S)-2-(1-adamantyl)-3-hydroxy-3-oxo-propanoate CAS Name: (2S)-2-(1-adamantyl)-3-hydroxy-3-oxopropanoate IUPAC Name: (2S)-2-(1-adamantyl)-3-hydroxy-3-oxopropanoate Traditional Name: (2S)-2-(1-adamantyl)-3-hydroxy-3-keto-propionate Formula: C13H17O4- MolecularWeight: 237.27168

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(C(=O)O)C(=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[C@H](C(=O)O)C(=O)[O-]

InChI

InChI=1S/C13H18O4/c14-11(15)10(12(16)17)13-4-7-1-8(5-13)3-9(2-7)6-13/h7-10H,1-6H2,(H,14,15)(H,16,17)/p-1