2-[2-[(3-fluorophenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid

Systemtic Name: 2-[2-[(3-fluorophenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid Openeye Name: 2-[2-[(3-fluorophenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid CAS Name: 2-[[[2-[(3-fluoroanilino)-oxomethyl]phenyl]seleno]thio]butanedioic acid IUPAC Name: 2-[2-[(3-fluorophenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid Traditional Name: 2-[[[2-[(3-fluorophenyl)carbamoyl]phenyl]seleno]thio]succinic acid Formula: C17H14FNO5SSe MolecularWeight: 442.320163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)F)[Se]SC(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)F)[Se]SC(CC(=O)O)C(=O)O

InChI

InChI=1S/C17H14FNO5SSe/c18-10-4-3-5-11(8-10)19-16(22)12-6-1-2-7-14(12)26-25-13(17(23)24)9-15(20)21/h1-8,13H,9H2,(H,19,22)(H,20,21)(H,23,24)