4-[4-[(5-bromanylfuran-2-yl)carbonylamino]pyrazol-1-yl]butanoic acid

Systemtic Name: 4-[4-[(5-bromanylfuran-2-yl)carbonylamino]pyrazol-1-yl]butanoic acid Openeye Name: 4-[4-[(5-bromofuran-2-carbonyl)amino]pyrazol-1-yl]butanoic acid CAS Name: 4-[4-[[(5-bromo-2-furanyl)-oxomethyl]amino]-1-pyrazolyl]butanoic acid IUPAC Name: 4-[4-[(5-bromofuran-2-carbonyl)amino]pyrazol-1-yl]butanoic acid Traditional Name: 4-[4-[(5-bromo-2-furoyl)amino]pyrazol-1-yl]butyric acid Formula: C12H12BrN3O4 MolecularWeight: 342.14538

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)Br)C(=O)NC2=CN(N=C2)CCCC(=O)O

Isomeric SMILES

C1=C(OC(=C1)Br)C(=O)NC2=CN(N=C2)CCCC(=O)O

InChI

InChI=1S/C12H12BrN3O4/c13-10-4-3-9(20-10)12(19)15-8-6-14-16(7-8)5-1-2-11(17)18/h3-4,6-7H,1-2,5H2,(H,15,19)(H,17,18)