(E)-3-(2-fluorophenyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-fluorophenyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)prop-2-enoic acid Openeye Name: (E)-3-(2-fluorophenyl)-2-(5-morpholinosulfonyl-2-thienyl)prop-2-enoic acid CAS Name: (E)-3-(2-fluorophenyl)-2-[5-(4-morpholinylsulfonyl)-2-thiophenyl]-2-propenoic acid IUPAC Name: (E)-3-(2-fluorophenyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)prop-2-enoic acid Traditional Name: (E)-3-(2-fluorophenyl)-2-(5-morpholinosulfonyl-2-thienyl)acrylic acid Formula: C17H16FNO5S2 MolecularWeight: 397.441043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(S2)C(=CC3=CC=CC=C3F)C(=O)O

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(S2)/C(=C/C3=CC=CC=C3F)/C(=O)O

InChI

InChI=1S/C17H16FNO5S2/c18-14-4-2-1-3-12(14)11-13(17(20)21)15-5-6-16(25-15)26(22,23)19-7-9-24-10-8-19/h1-6,11H,7-10H2,(H,20,21)/b13-11-