2-(3,5-dimethyl-1-adamantyl)-3-oxidanylidene-butanedioic acid

Systemtic Name: 2-(3,5-dimethyl-1-adamantyl)-3-oxidanylidene-butanedioic acid Openeye Name: 2-(3,5-dimethyl-1-adamantyl)-3-oxo-butanedioic acid CAS Name: 2-(3,5-dimethyl-1-adamantyl)-3-oxobutanedioic acid IUPAC Name: 2-(3,5-dimethyl-1-adamantyl)-3-oxobutanedioic acid Traditional Name: 2-(3,5-dimethyl-1-adamantyl)-3-keto-succinic acid Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O5/c1-14-3-9-4-15(2,6-14)8-16(5-9,7-14)10(12(18)19)11(17)13(20)21/h9-10H,3-8H2,1-2H3,(H,18,19)(H,20,21)