2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]benzoic acid

Systemtic Name: 2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]benzoic acid Openeye Name: 2-[[5-(2-furyl)isoxazol-3-yl]methylsulfanyl]benzoic acid CAS Name: 2-[[5-(2-furanyl)-3-isoxazolyl]methylthio]benzoic acid IUPAC Name: 2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]benzoic acid Traditional Name: 2-[[5-(2-furyl)isoxazol-3-yl]methylthio]benzoic acid Formula: C15H11NO4S MolecularWeight: 301.31714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)SCC2=NOC(=C2)C3=CC=CO3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)SCC2=NOC(=C2)C3=CC=CO3

InChI

InChI=1S/C15H11NO4S/c17-15(18)11-4-1-2-6-14(11)21-9-10-8-13(20-16-10)12-5-3-7-19-12/h1-8H,9H2,(H,17,18)