3-[(E)-1-(phenylsulfonyl)non-1-en-3-yl]pentane-2,4-dione

Systemtic Name: 3-[(E)-1-(phenylsulfonyl)non-1-en-3-yl]pentane-2,4-dione Openeye Name: 3-[1-[(E)-2-(benzenesulfonyl)vinyl]heptyl]pentane-2,4-dione CAS Name: 3-[(E)-1-(benzenesulfonyl)non-1-en-3-yl]pentane-2,4-dione IUPAC Name: 3-[(E)-1-(benzenesulfonyl)non-1-en-3-yl]pentane-2,4-dione Traditional Name: 3-[(E)-3-besyl-1-hexyl-allyl]pentane-2,4-dione Formula: C20H28O4S MolecularWeight: 364.49892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C=CS(=O)(=O)C1=CC=CC=C1)C(C(=O)C)C(=O)C

Isomeric SMILES

CCCCCCC(/C=C/S(=O)(=O)C1=CC=CC=C1)C(C(=O)C)C(=O)C

InChI

InChI=1S/C20H28O4S/c1-4-5-6-8-11-18(20(16(2)21)17(3)22)14-15-25(23,24)19-12-9-7-10-13-19/h7,9-10,12-15,18,20H,4-6,8,11H2,1-3H3/b15-14+