7-(3-methyl-2-oxidanyl-butan-2-yl)adamantane-1,3,5-tricarboxylic acid

Systemtic Name: 7-(3-methyl-2-oxidanyl-butan-2-yl)adamantane-1,3,5-tricarboxylic acid Openeye Name: 7-(1-hydroxy-1,2-dimethyl-propyl)adamantane-1,3,5-tricarboxylic acid CAS Name: 7-(2-hydroxy-3-methylbutan-2-yl)adamantane-1,3,5-tricarboxylic acid IUPAC Name: 7-(2-hydroxy-3-methylbutan-2-yl)adamantane-1,3,5-tricarboxylic acid Traditional Name: 7-(1-hydroxy-1,2-dimethyl-propyl)adamantane-1,3,5-tricarboxylic acid Formula: C18H26O7 MolecularWeight: 354.39484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C12CC3(CC(C1)(CC(C3)(C2)C(=O)O)C(=O)O)C(=O)O)O

Isomeric SMILES

CC(C)C(C)(C12CC3(CC(C1)(CC(C3)(C2)C(=O)O)C(=O)O)C(=O)O)O

InChI

InChI=1S/C18H26O7/c1-10(2)14(3,25)18-7-15(11(19)20)4-16(8-18,12(21)22)6-17(5-15,9-18)13(23)24/h10,25H,4-9H2,1-3H3,(H,19,20)(H,21,22)(H,23,24)