2-(2,2-diphenethyloxy-2-thiophen-2-yl-ethyl)-4-[(E)-3-(4-fluorophenyl)prop-2-enoxy]-3-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: 2-(2,2-diphenethyloxy-2-thiophen-2-yl-ethyl)-4-[(E)-3-(4-fluorophenyl)prop-2-enoxy]-3-oxidanyl-4-oxidanylidene-butanoate Openeye Name: 2-[2,2-diphenethyloxy-2-(2-thienyl)ethyl]-4-[(E)-3-(4-fluorophenyl)allyloxy]-3-hydroxy-4-oxo-butanoate CAS Name: 2-(2,2-diphenethyloxy-2-thiophen-2-ylethyl)-4-[(E)-3-(4-fluorophenyl)prop-2-enoxy]-3-hydroxy-4-oxobutanoate IUPAC Name: 2-(2,2-diphenethyloxy-2-thiophen-2-ylethyl)-4-[(E)-3-(4-fluorophenyl)prop-2-enoxy]-3-hydroxy-4-oxobutanoate Traditional Name: 2-[2,2-diphenethyloxy-2-(2-thienyl)ethyl]-4-[(E)-3-(4-fluorophenyl)allyloxy]-3-hydroxy-4-keto-butyrate Formula: C35H34FO7S- MolecularWeight: 617.703663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC(CC(C(C(=O)OCC=CC2=CC=C(C=C2)F)O)C(=O)[O-])(C3=CC=CS3)OCCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCOC(CC(C(C(=O)OC/C=C/C2=CC=C(C=C2)F)O)C(=O)[O-])(C3=CC=CS3)OCCC4=CC=CC=C4

InChI

InChI=1S/C35H35FO7S/c36-29-17-15-28(16-18-29)13-7-21-41-34(40)32(37)30(33(38)39)25-35(31-14-8-24-44-31,42-22-19-26-9-3-1-4-10-26)43-23-20-27-11-5-2-6-12-27/h1-18,24,30,32,37H,19-23,25H2,(H,38,39)/p-1/b13-7+