1-(4-nonylphenyl)-2-oxidanyl-heptane-1,4-dione

Systemtic Name: 1-(4-nonylphenyl)-2-oxidanyl-heptane-1,4-dione Openeye Name: 2-hydroxy-1-(4-nonylphenyl)heptane-1,4-dione CAS Name: 2-hydroxy-1-(4-nonylphenyl)heptane-1,4-dione IUPAC Name: 2-hydroxy-1-(4-nonylphenyl)heptane-1,4-dione Traditional Name: 2-hydroxy-1-(4-nonylphenyl)heptane-1,4-dione Formula: C22H34O3 MolecularWeight: 346.50356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C(=O)C(CC(=O)CCC)O

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C(=O)C(CC(=O)CCC)O

InChI

InChI=1S/C22H34O3/c1-3-5-6-7-8-9-10-12-18-13-15-19(16-14-18)22(25)21(24)17-20(23)11-4-2/h13-16,21,24H,3-12,17H2,1-2H3