4-[4-[[(2R)-2-(4-nitropyrazol-1-yl)propanoyl]amino]pyrazol-1-yl]butanoic acid

Systemtic Name: 4-[4-[[(2R)-2-(4-nitropyrazol-1-yl)propanoyl]amino]pyrazol-1-yl]butanoic acid Openeye Name: 4-[4-[[(2R)-2-(4-nitropyrazol-1-yl)propanoyl]amino]pyrazol-1-yl]butanoic acid CAS Name: 4-[4-[[(2R)-2-(4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-1-pyrazolyl]butanoic acid IUPAC Name: 4-[4-[[(2R)-2-(4-nitropyrazol-1-yl)propanoyl]amino]pyrazol-1-yl]butanoic acid Traditional Name: 4-[4-[[(2R)-2-(4-nitropyrazol-1-yl)propanoyl]amino]pyrazol-1-yl]butyric acid Formula: C13H16N6O5 MolecularWeight: 336.30334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CN(N=C1)CCCC(=O)O)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1=CN(N=C1)CCCC(=O)O)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N6O5/c1-9(18-8-11(6-15-18)19(23)24)13(22)16-10-5-14-17(7-10)4-2-3-12(20)21/h5-9H,2-4H2,1H3,(H,16,22)(H,20,21)/t9-/m1/s1