4-[4-(2-phenoxyethanoylamino)pyrazol-1-yl]butanoic acid

Systemtic Name: 4-[4-(2-phenoxyethanoylamino)pyrazol-1-yl]butanoic acid Openeye Name: 4-[4-[(2-phenoxyacetyl)amino]pyrazol-1-yl]butanoic acid CAS Name: 4-[4-[(1-oxo-2-phenoxyethyl)amino]-1-pyrazolyl]butanoic acid IUPAC Name: 4-[4-[(2-phenoxyacetyl)amino]pyrazol-1-yl]butanoic acid Traditional Name: 4-[4-[(2-phenoxyacetyl)amino]pyrazol-1-yl]butyric acid Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NC2=CN(N=C2)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NC2=CN(N=C2)CCCC(=O)O

InChI

InChI=1S/C15H17N3O4/c19-14(11-22-13-5-2-1-3-6-13)17-12-9-16-18(10-12)8-4-7-15(20)21/h1-3,5-6,9-10H,4,7-8,11H2,(H,17,19)(H,20,21)