(E)-4-[(4-fluorophenyl)-(thiophen-2-ylmethyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(4-fluorophenyl)-(thiophen-2-ylmethyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[4-fluoro-N-(2-thienylmethyl)anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[4-fluoro-N-(thiophen-2-ylmethyl)anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[4-fluoro-N-(thiophen-2-ylmethyl)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[4-fluoro-N-(2-thenyl)anilino]-4-keto-but-2-enoic acid Formula: C15H12FNO3S MolecularWeight: 305.324083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CN(C2=CC=C(C=C2)F)C(=O)C=CC(=O)O

Isomeric SMILES

C1=CSC(=C1)CN(C2=CC=C(C=C2)F)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C15H12FNO3S/c16-11-3-5-12(6-4-11)17(10-13-2-1-9-21-13)14(18)7-8-15(19)20/h1-9H,10H2,(H,19,20)/b8-7+