3-[5-[[5-(furan-2-ylmethylcarbamoyl)-1-methyl-pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[5-[[5-(furan-2-ylmethylcarbamoyl)-1-methyl-pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[5-[[5-(2-furylmethylcarbamoyl)-1-methyl-pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[5-[[[5-[(2-furanylmethylamino)-oxomethyl]-1-methyl-4-pyrazolyl]amino]-oxomethyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[5-[[5-(furan-2-ylmethylcarbamoyl)-1-methylpyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[5-[[5-(2-furfurylcarbamoyl)-1-methyl-pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propionic acid Formula: C17H18N6O5 MolecularWeight: 386.36202

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)NC(=O)C2=CC=NN2CCC(=O)O)C(=O)NCC3=CC=CO3

Isomeric SMILES

CN1C(=C(C=N1)NC(=O)C2=CC=NN2CCC(=O)O)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C17H18N6O5/c1-22-15(17(27)18-9-11-3-2-8-28-11)12(10-20-22)21-16(26)13-4-6-19-23(13)7-5-14(24)25/h2-4,6,8,10H,5,7,9H2,1H3,(H,18,27)(H,21,26)(H,24,25)