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

Systemtic Name: 3-[(E)-4-methyl-1-(phenylsulfonyl)pent-1-en-3-yl]pentane-2,4-dione Openeye Name: 3-[(E)-3-(benzenesulfonyl)-1-isopropyl-allyl]pentane-2,4-dione CAS Name: 3-[(E)-1-(benzenesulfonyl)-4-methylpent-1-en-3-yl]pentane-2,4-dione IUPAC Name: 3-[(E)-1-(benzenesulfonyl)-4-methylpent-1-en-3-yl]pentane-2,4-dione Traditional Name: 3-[(E)-3-besyl-1-isopropyl-allyl]pentane-2,4-dione Formula: C17H22O4S MolecularWeight: 322.41918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22O4S/c1-12(2)16(17(13(3)18)14(4)19)10-11-22(20,21)15-8-6-5-7-9-15/h5-12,16-17H,1-4H3/b11-10+