(E)-1-[(4S,5S)-5-methyl-2-oxidanylidene-1,3,2-dioxathiolan-4-yl]-7-phenylmethoxy-hept-1-en-3-one

Systemtic Name: (E)-1-[(4S,5S)-5-methyl-2-oxidanylidene-1,3,2-dioxathiolan-4-yl]-7-phenylmethoxy-hept-1-en-3-one Openeye Name: (E)-7-benzyloxy-1-[(4S,5S)-5-methyl-2-oxo-1,3,2-dioxathiolan-4-yl]hept-1-en-3-one CAS Name: (E)-1-[(4S,5S)-5-methyl-2-oxo-1,3,2-dioxathiolan-4-yl]-7-phenylmethoxy-1-hepten-3-one IUPAC Name: (E)-1-[(4S,5S)-5-methyl-2-oxo-1,3,2-dioxathiolan-4-yl]-7-phenylmethoxyhept-1-en-3-one Traditional Name: (E)-7-benzoxy-1-[(4S,5S)-2-keto-5-methyl-1,3,2-dioxathiolan-4-yl]hept-1-en-3-one Formula: C17H22O5S MolecularWeight: 338.41858

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OS(=O)O1)C=CC(=O)CCCCOCC2=CC=CC=C2

Isomeric SMILES

C[C@H]1[C@@H](OS(=O)O1)/C=C/C(=O)CCCCOCC2=CC=CC=C2

InChI

InChI=1S/C17H22O5S/c1-14-17(22-23(19)21-14)11-10-16(18)9-5-6-12-20-13-15-7-3-2-4-8-15/h2-4,7-8,10-11,14,17H,5-6,9,12-13H2,1H3/b11-10+/t14-,17-,23?/m0/s1