(E)-2-(1-adamantylmethyl)-3-oxidanyl-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (E)-2-(1-adamantylmethyl)-3-oxidanyl-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (E)-2-(1-adamantylmethyl)-3-hydroxy-3-oxo-prop-1-en-1-olate CAS Name: (E)-2-(1-adamantylmethyl)-3-hydroxy-3-oxo-1-propen-1-olate IUPAC Name: (E)-2-(1-adamantylmethyl)-3-hydroxy-3-oxoprop-1-en-1-olate Traditional Name: (E)-2-(1-adamantylmethyl)-3-hydroxy-3-keto-prop-1-en-1-olate Formula: C14H19O3- MolecularWeight: 235.29886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O3/c15-8-12(13(16)17)7-14-4-9-1-10(5-14)3-11(2-9)6-14/h8-11,15H,1-7H2,(H,16,17)/p-1/b12-8+