(Z)-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-3-(4-fluorophenyl)prop-2-enoic acid

Systemtic Name: (Z)-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-3-(4-fluorophenyl)prop-2-enoic acid Openeye Name: (Z)-2-(2-ethoxy-2-oxo-ethyl)sulfanyl-3-(4-fluorophenyl)prop-2-enoic acid CAS Name: (Z)-2-[(2-ethoxy-2-oxoethyl)thio]-3-(4-fluorophenyl)-2-propenoic acid IUPAC Name: (Z)-2-(2-ethoxy-2-oxoethyl)sulfanyl-3-(4-fluorophenyl)prop-2-enoic acid Traditional Name: (Z)-2-[(2-ethoxy-2-keto-ethyl)thio]-3-(4-fluorophenyl)acrylic acid Formula: C13H13FO4S MolecularWeight: 284.303323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=CC1=CC=C(C=C1)F)C(=O)O

Isomeric SMILES

CCOC(=O)CS/C(=C\C1=CC=C(C=C1)F)/C(=O)O

InChI

InChI=1S/C13H13FO4S/c1-2-18-12(15)8-19-11(13(16)17)7-9-3-5-10(14)6-4-9/h3-7H,2,8H2,1H3,(H,16,17)/b11-7-