(E,1S,2R,3R)-2-ethenyl-7-(3-hydroxyphenyl)-6-methyl-1-thiophen-2-yl-hept-6-ene-1,3-diol

Systemtic Name: (E,1S,2R,3R)-2-ethenyl-7-(3-hydroxyphenyl)-6-methyl-1-thiophen-2-yl-hept-6-ene-1,3-diol Openeye Name: (E,1S,2R,3R)-7-(3-hydroxyphenyl)-6-methyl-1-(2-thienyl)-2-vinyl-hept-6-ene-1,3-diol CAS Name: (E,1S,2R,3R)-2-ethenyl-7-(3-hydroxyphenyl)-6-methyl-1-thiophen-2-yl-6-heptene-1,3-diol IUPAC Name: (E,1S,2R,3R)-2-ethenyl-7-(3-hydroxyphenyl)-6-methyl-1-thiophen-2-ylhept-6-ene-1,3-diol Traditional Name: (E,1S,2R,3R)-7-(3-hydroxyphenyl)-6-methyl-1-(2-thienyl)-2-vinyl-hept-6-ene-1,3-diol Formula: C20H24O3S MolecularWeight: 344.46776

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=CC=C1)O)CCC(C(C=C)C(C2=CC=CS2)O)O

Isomeric SMILES

C/C(=C\C1=CC(=CC=C1)O)/CC[C@H]([C@@H](C=C)[C@@H](C2=CC=CS2)O)O

InChI

InChI=1S/C20H24O3S/c1-3-17(20(23)19-8-5-11-24-19)18(22)10-9-14(2)12-15-6-4-7-16(21)13-15/h3-8,11-13,17-18,20-23H,1,9-10H2,2H3/b14-12+/t17-,18-,20+/m1/s1