15-methyl-2-oxidanyl-hexadecane-1,3,3-tricarboxylic acid

Systemtic Name: 15-methyl-2-oxidanyl-hexadecane-1,3,3-tricarboxylic acid Openeye Name: 2-hydroxy-15-methyl-hexadecane-1,3,3-tricarboxylic acid CAS Name: 2-hydroxy-15-methylhexadecane-1,3,3-tricarboxylic acid IUPAC Name: 2-hydroxy-15-methylhexadecane-1,3,3-tricarboxylic acid Traditional Name: 2-hydroxy-15-methyl-hexadecane-1,3,3-tricarboxylic acid Formula: C20H36O7 MolecularWeight: 388.49564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCC(C(CC(=O)O)O)(C(=O)O)C(=O)O

Isomeric SMILES

CC(C)CCCCCCCCCCCC(C(CC(=O)O)O)(C(=O)O)C(=O)O

InChI

InChI=1S/C20H36O7/c1-15(2)12-10-8-6-4-3-5-7-9-11-13-20(18(24)25,19(26)27)16(21)14-17(22)23/h15-16,21H,3-14H2,1-2H3,(H,22,23)(H,24,25)(H,26,27)