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2,2-bis(6-methylheptyl)hexanedioic acid

2,2-bis(6-methylheptyl)hexanedioic acid

Systemtic Name:2,2-bis(6-methylheptyl)hexanedioic acid
Openeye Name:2,2-bis(6-methylheptyl)hexanedioic acid
CAS Name:2,2-bis(6-methylheptyl)hexanedioic acid
IUPAC Name:2,2-bis(6-methylheptyl)hexanedioic acid
Traditional Name:2,2-bis(6-methylheptyl)adipic acid
Formula: C22H42O4
MolecularWeight: 370.56648
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC(CCCCCC(C)C)(CCCC(=O)O)C(=O)O


Isomeric SMILES

CC(C)CCCCCC(CCCCCC(C)C)(CCCC(=O)O)C(=O)O


InChI

InChI=1S/C22H42O4/c1-18(2)12-7-5-9-15-22(21(25)26,17-11-14-20(23)24)16-10-6-8-13-19(3)4/h18-19H,5-17H2,1-4H3,(H,23,24)(H,25,26)


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