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

Systemtic Name: 4-[4-[(2-nitrophenyl)carbonylamino]pyrazol-1-yl]butanoic acid Openeye Name: 4-[4-[(2-nitrobenzoyl)amino]pyrazol-1-yl]butanoic acid CAS Name: 4-[4-[[(2-nitrophenyl)-oxomethyl]amino]-1-pyrazolyl]butanoic acid IUPAC Name: 4-[4-[(2-nitrobenzoyl)amino]pyrazol-1-yl]butanoic acid Traditional Name: 4-[4-[(2-nitrobenzoyl)amino]pyrazol-1-yl]butyric acid Formula: C14H14N4O5 MolecularWeight: 318.28476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CN(N=C2)CCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CN(N=C2)CCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O5/c19-13(20)6-3-7-17-9-10(8-15-17)16-14(21)11-4-1-2-5-12(11)18(22)23/h1-2,4-5,8-9H,3,6-7H2,(H,16,21)(H,19,20)