3-fluoranyl-4-(4-thiophen-2-ylbutylamino)benzoic acid

Systemtic Name: 3-fluoranyl-4-(4-thiophen-2-ylbutylamino)benzoic acid Openeye Name: 3-fluoro-4-[4-(2-thienyl)butylamino]benzoic acid CAS Name: 3-fluoro-4-(4-thiophen-2-ylbutylamino)benzoic acid IUPAC Name: 3-fluoro-4-(4-thiophen-2-ylbutylamino)benzoic acid Traditional Name: 3-fluoro-4-[4-(2-thienyl)butylamino]benzoic acid Formula: C15H16FNO2S MolecularWeight: 293.356443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCCCNC2=C(C=C(C=C2)C(=O)O)F

Isomeric SMILES

C1=CSC(=C1)CCCCNC2=C(C=C(C=C2)C(=O)O)F

InChI

InChI=1S/C15H16FNO2S/c16-13-10-11(15(18)19)6-7-14(13)17-8-2-1-4-12-5-3-9-20-12/h3,5-7,9-10,17H,1-2,4,8H2,(H,18,19)