3-[(E)-2-methyl-3-oxidanyl-3-oxidanylidene-prop-1-enyl]adamantane-1-carboxylic acid

Systemtic Name: 3-[(E)-2-methyl-3-oxidanyl-3-oxidanylidene-prop-1-enyl]adamantane-1-carboxylic acid Openeye Name: 3-[(E)-3-hydroxy-2-methyl-3-oxo-prop-1-enyl]adamantane-1-carboxylic acid CAS Name: 3-[(E)-3-hydroxy-2-methyl-3-oxoprop-1-enyl]-1-adamantanecarboxylic acid IUPAC Name: 3-[(E)-3-hydroxy-2-methyl-3-oxoprop-1-enyl]adamantane-1-carboxylic acid Traditional Name: 3-[(E)-3-hydroxy-3-keto-2-methyl-prop-1-enyl]adamantane-1-carboxylic acid Formula: C15H20O4 MolecularWeight: 264.3169

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC12CC3CC(C1)CC(C3)(C2)C(=O)O)C(=O)O

Isomeric SMILES

C/C(=C\C12CC3CC(C1)CC(C3)(C2)C(=O)O)/C(=O)O

InChI

InChI=1S/C15H20O4/c1-9(12(16)17)3-14-4-10-2-11(5-14)7-15(6-10,8-14)13(18)19/h3,10-11H,2,4-8H2,1H3,(H,16,17)(H,18,19)/b9-3+