3-[(4-dodecylphenyl)-oxidanyl-methyl]-3,4-bis(oxidanyl)pentanoic acid

Systemtic Name: 3-[(4-dodecylphenyl)-oxidanyl-methyl]-3,4-bis(oxidanyl)pentanoic acid Openeye Name: 3-[(4-dodecylphenyl)-hydroxy-methyl]-3,4-dihydroxy-pentanoic acid CAS Name: 3-[(4-dodecylphenyl)-hydroxymethyl]-3,4-dihydroxypentanoic acid IUPAC Name: 3-[(4-dodecylphenyl)-hydroxymethyl]-3,4-dihydroxypentanoic acid Traditional Name: 3,4-dihydroxy-3-[hydroxy-(4-laurylphenyl)methyl]valeric acid Formula: C24H40O5 MolecularWeight: 408.5714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C(C(CC(=O)O)(C(C)O)O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C(C(CC(=O)O)(C(C)O)O)O

InChI

InChI=1S/C24H40O5/c1-3-4-5-6-7-8-9-10-11-12-13-20-14-16-21(17-15-20)23(28)24(29,19(2)25)18-22(26)27/h14-17,19,23,25,28-29H,3-13,18H2,1-2H3,(H,26,27)