3-methyl-2,5-bis(3-methylpentyl)hexanedioic acid

Systemtic Name: 3-methyl-2,5-bis(3-methylpentyl)hexanedioic acid Openeye Name: 3-methyl-2,5-bis(3-methylpentyl)hexanedioic acid CAS Name: 3-methyl-2,5-bis(3-methylpentyl)hexanedioic acid IUPAC Name: 3-methyl-2,5-bis(3-methylpentyl)hexanedioic acid Traditional Name: 3-methyl-2,5-bis(3-methylpentyl)adipic acid Formula: C19H36O4 MolecularWeight: 328.48674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCC(CC(C)C(CCC(C)CC)C(=O)O)C(=O)O

Isomeric SMILES

CCC(C)CCC(CC(C)C(CCC(C)CC)C(=O)O)C(=O)O

InChI

InChI=1S/C19H36O4/c1-6-13(3)8-10-16(18(20)21)12-15(5)17(19(22)23)11-9-14(4)7-2/h13-17H,6-12H2,1-5H3,(H,20,21)(H,22,23)