(3S,6E,10S)-6,10-dimethyl-1-(phenylsulfinyl)-3-propan-2-yl-tetradeca-6,13-diene-2,12-dione

Systemtic Name: (3S,6E,10S)-6,10-dimethyl-1-(phenylsulfinyl)-3-propan-2-yl-tetradeca-6,13-diene-2,12-dione Openeye Name: (3S,6E,10S)-1-(benzenesulfinyl)-3-isopropyl-6,10-dimethyl-tetradeca-6,13-diene-2,12-dione CAS Name: (3S,6E,10S)-1-(benzenesulfinyl)-6,10-dimethyl-3-propan-2-yltetradeca-6,13-diene-2,12-dione IUPAC Name: (3S,6E,10S)-1-(benzenesulfinyl)-6,10-dimethyl-3-propan-2-yltetradeca-6,13-diene-2,12-dione Traditional Name: (3S,6E,10S)-1-(benzenesulfinyl)-3-isopropyl-6,10-dimethyl-tetradeca-6,13-diene-2,12-dione Formula: C25H36O3S MolecularWeight: 416.61654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](CC/C=C(\C)/CC[C@@H](C(C)C)C(=O)CS(=O)C1=CC=CC=C1)CC(=O)C=C

InChI

InChI=1S/C25H36O3S/c1-6-22(26)17-21(5)12-10-11-20(4)15-16-24(19(2)3)25(27)18-29(28)23-13-8-7-9-14-23/h6-9,11,13-14,19,21,24H,1,10,12,15-18H2,2-5H3/b20-11+/t21-,24-,29?/m0/s1