4-(1-adamantyl)-4-oxidanylidene-butanoate

Systemtic Name: 4-(1-adamantyl)-4-oxidanylidene-butanoate Openeye Name: 4-(1-adamantyl)-4-oxo-butanoate CAS Name: 4-(1-adamantyl)-4-oxobutanoate IUPAC Name: 4-(1-adamantyl)-4-oxobutanoate Traditional Name: 4-(1-adamantyl)-4-keto-butyrate Formula: C14H19O3- MolecularWeight: 235.29886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O3/c15-12(1-2-13(16)17)14-6-9-3-10(7-14)5-11(4-9)8-14/h9-11H,1-8H2,(H,16,17)/p-1