2,2-bis(5-methyl-1-oxidanyl-2-propan-2-yl-cyclohexyl)pentanoic acid

Systemtic Name: 2,2-bis(5-methyl-1-oxidanyl-2-propan-2-yl-cyclohexyl)pentanoic acid Openeye Name: 2,2-bis(1-hydroxy-2-isopropyl-5-methyl-cyclohexyl)pentanoic acid CAS Name: 2,2-bis(1-hydroxy-5-methyl-2-propan-2-ylcyclohexyl)pentanoic acid IUPAC Name: 2,2-bis(1-hydroxy-5-methyl-2-propan-2-ylcyclohexyl)pentanoic acid Traditional Name: 2,2-bis(1-hydroxy-2-isopropyl-5-methyl-cyclohexyl)valeric acid Formula: C25H46O4 MolecularWeight: 410.63034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)(C1(CC(CCC1C(C)C)C)O)C2(CC(CCC2C(C)C)C)O

Isomeric SMILES

CCCC(C(=O)O)(C1(CC(CCC1C(C)C)C)O)C2(CC(CCC2C(C)C)C)O

InChI

InChI=1S/C25H46O4/c1-8-13-23(22(26)27,24(28)14-18(6)9-11-20(24)16(2)3)25(29)15-19(7)10-12-21(25)17(4)5/h16-21,28-29H,8-15H2,1-7H3,(H,26,27)