hexanedioic acid; 1-pentadecoxypentadecane

Systemtic Name: hexanedioic acid; 1-pentadecoxypentadecane Openeye Name: adipic acid; 1-pentadecoxypentadecane CAS Name: hexanedioic acid; 1-pentadecoxypentadecane IUPAC Name: hexanedioic acid; 1-pentadecoxypentadecane Traditional Name: adipic acid; 1-pentadecoxypentadecane Formula: C36H72O5 MolecularWeight: 584.95388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H62O.C6H10O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;7-5(8)3-1-2-4-6(9)10/h3-30H2,1-2H3;1-4H2,(H,7,8)(H,9,10)