propan-2-yl 3-(2-nitrophenyl)-3-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoylamino]propanoate

Systemtic Name: propan-2-yl 3-(2-nitrophenyl)-3-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoylamino]propanoate Openeye Name: isopropyl 3-(2-nitrophenyl)-3-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]propanoate CAS Name: 3-(2-nitrophenyl)-3-[[1-oxo-2-(1,3,5-trimethyl-4-pyrazolyl)ethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-nitrophenyl)-3-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]propanoate Traditional Name: 3-(2-nitrophenyl)-3-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]propionic acid isopropyl ester Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CC(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)CC(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O5/c1-12(2)29-20(26)11-17(15-8-6-7-9-18(15)24(27)28)21-19(25)10-16-13(3)22-23(5)14(16)4/h6-9,12,17H,10-11H2,1-5H3,(H,21,25)