methyl 2-methyl-2-[2-(4-nitropyrazol-1-yl)ethanoylamino]pentanoate

Systemtic Name: methyl 2-methyl-2-[2-(4-nitropyrazol-1-yl)ethanoylamino]pentanoate Openeye Name: methyl 2-methyl-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]pentanoate CAS Name: 2-methyl-2-[[2-(4-nitro-1-pyrazolyl)-1-oxoethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]pentanoate Traditional Name: 2-methyl-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]valeric acid methyl ester Formula: C12H18N4O5 MolecularWeight: 298.29512

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)OC)NC(=O)CN1C=C(C=N1)[N+](=O)[O-]

Isomeric SMILES

CCCC(C)(C(=O)OC)NC(=O)CN1C=C(C=N1)[N+](=O)[O-]

InChI

InChI=1S/C12H18N4O5/c1-4-5-12(2,11(18)21-3)14-10(17)8-15-7-9(6-13-15)16(19)20/h6-7H,4-5,8H2,1-3H3,(H,14,17)