4-(hydroxymethyl)-4-(4-oxidanylbutyl)heptane-2,6-dione

Systemtic Name: 4-(hydroxymethyl)-4-(4-oxidanylbutyl)heptane-2,6-dione Openeye Name: 4-(4-hydroxybutyl)-4-(hydroxymethyl)heptane-2,6-dione CAS Name: 4-(4-hydroxybutyl)-4-(hydroxymethyl)heptane-2,6-dione IUPAC Name: 4-(4-hydroxybutyl)-4-(hydroxymethyl)heptane-2,6-dione Traditional Name: 4-(4-hydroxybutyl)-4-methylol-heptane-2,6-dione Formula: C12H22O4 MolecularWeight: 230.30068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CCCCO)(CC(=O)C)CO

Isomeric SMILES

CC(=O)CC(CCCCO)(CC(=O)C)CO

InChI

InChI=1S/C12H22O4/c1-10(15)7-12(9-14,8-11(2)16)5-3-4-6-13/h13-14H,3-9H2,1-2H3