4-[4-(furan-2-yl)but-3-ynylamino]benzoic acid

Systemtic Name: 4-[4-(furan-2-yl)but-3-ynylamino]benzoic acid Openeye Name: 4-[4-(2-furyl)but-3-ynylamino]benzoic acid CAS Name: 4-[4-(2-furanyl)but-3-ynylamino]benzoic acid IUPAC Name: 4-[4-(furan-2-yl)but-3-ynylamino]benzoic acid Traditional Name: 4-[4-(2-furyl)but-3-ynylamino]benzoic acid Formula: C15H13NO3 MolecularWeight: 255.26862

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C#CCCNC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=COC(=C1)C#CCCNC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H13NO3/c17-15(18)12-6-8-13(9-7-12)16-10-2-1-4-14-5-3-11-19-14/h3,5-9,11,16H,2,10H2,(H,17,18)