4-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)-methyl-amino]butanoic acid

Systemtic Name: 4-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)-methyl-amino]butanoic acid Openeye Name: 4-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)-methyl-amino]butanoic acid CAS Name: 4-[(2,5-dimethyl-4-nitro-3-pyrazolyl)-methylamino]butanoic acid IUPAC Name: 4-[(2,5-dimethyl-4-nitropyrazol-3-yl)-methylamino]butanoic acid Traditional Name: 4-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)-methyl-amino]butyric acid Formula: C10H16N4O4 MolecularWeight: 256.25844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])N(C)CCCC(=O)O)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])N(C)CCCC(=O)O)C

InChI

InChI=1S/C10H16N4O4/c1-7-9(14(17)18)10(13(3)11-7)12(2)6-4-5-8(15)16/h4-6H2,1-3H3,(H,15,16)