(Z)-2-(1-adamantyl)-3-oxidanyl-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-2-(1-adamantyl)-3-oxidanyl-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (Z)-2-(1-adamantyl)-3-hydroxy-3-oxo-prop-1-en-1-olate CAS Name: (Z)-2-(1-adamantyl)-3-hydroxy-3-oxo-1-propen-1-olate IUPAC Name: (Z)-2-(1-adamantyl)-3-hydroxy-3-oxoprop-1-en-1-olate Traditional Name: (Z)-2-(1-adamantyl)-3-hydroxy-3-keto-prop-1-en-1-olate Formula: C13H17O3- MolecularWeight: 221.27228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3/c14-7-11(12(15)16)13-4-8-1-9(5-13)3-10(2-8)6-13/h7-10,14H,1-6H2,(H,15,16)/p-1/b11-7+