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

Systemtic Name: (2S)-2-(1-adamantyl)-3-methoxy-3-oxidanylidene-propanoate Openeye Name: (2S)-2-(1-adamantyl)-3-methoxy-3-oxo-propanoate CAS Name: (2S)-2-(1-adamantyl)-3-methoxy-3-oxopropanoate IUPAC Name: (2S)-2-(1-adamantyl)-3-methoxy-3-oxopropanoate Traditional Name: (2S)-2-(1-adamantyl)-3-keto-3-methoxy-propionate Formula: C14H19O4- MolecularWeight: 251.29826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=O)[O-])C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

COC(=O)[C@H](C(=O)[O-])C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C14H20O4/c1-18-13(17)11(12(15)16)14-5-8-2-9(6-14)4-10(3-8)7-14/h8-11H,2-7H2,1H3,(H,15,16)/p-1/t8?,9?,10?,11-,14?/m0/s1