2,6-dibutyl-4-(hydroxymethyl)-4-oxidanyl-heptanedial

Systemtic Name: 2,6-dibutyl-4-(hydroxymethyl)-4-oxidanyl-heptanedial Openeye Name: 2,6-dibutyl-4-hydroxy-4-(hydroxymethyl)heptanedial CAS Name: 2,6-dibutyl-4-hydroxy-4-(hydroxymethyl)heptanedial IUPAC Name: 2,6-dibutyl-4-hydroxy-4-(hydroxymethyl)heptanedial Traditional Name: 2,6-dibutyl-4-hydroxy-4-methylol-pimelaldehyde Formula: C16H30O4 MolecularWeight: 286.407

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(CC(CCCC)C=O)(CO)O)C=O

Isomeric SMILES

CCCCC(CC(CC(CCCC)C=O)(CO)O)C=O

InChI

InChI=1S/C16H30O4/c1-3-5-7-14(11-17)9-16(20,13-19)10-15(12-18)8-6-4-2/h11-12,14-15,19-20H,3-10,13H2,1-2H3