hexanedioic acid; 10-methylundecane-2,4-diol

Systemtic Name: hexanedioic acid; 10-methylundecane-2,4-diol Openeye Name: adipic acid; 10-methylundecane-2,4-diol CAS Name: hexanedioic acid; 10-methylundecane-2,4-diol IUPAC Name: hexanedioic acid; 10-methylundecane-2,4-diol Traditional Name: adipic acid; 10-methylundecane-2,4-diol Formula: C18H36O6 MolecularWeight: 348.47484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC(CC(C)O)O.C(CCC(=O)O)CC(=O)O

Isomeric SMILES

CC(C)CCCCCC(CC(C)O)O.C(CCC(=O)O)CC(=O)O

InChI

InChI=1S/C12H26O2.C6H10O4/c1-10(2)7-5-4-6-8-12(14)9-11(3)13;7-5(8)3-1-2-4-6(9)10/h10-14H,4-9H2,1-3H3;1-4H2,(H,7,8)(H,9,10)