propan-2-yl 3-[[1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazol-4-yl]carbonylamino]-3-(2-nitrophenyl)propanoate

Systemtic Name: propan-2-yl 3-[[1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazol-4-yl]carbonylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[[1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carbonyl]amino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[[1-(6-ethoxy-3-pyridazinyl)-5-methyl-4-pyrazolyl]-oxomethyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[1-(6-ethoxypyridazin-3-yl)-5-methylpyrazole-4-carbonyl]amino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[[1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carbonyl]amino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C23H26N6O6 MolecularWeight: 482.48914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NC(CC(=O)OC(C)C)C3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CCOC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NC(CC(=O)OC(C)C)C3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C23H26N6O6/c1-5-34-21-11-10-20(26-27-21)28-15(4)17(13-24-28)23(31)25-18(12-22(30)35-14(2)3)16-8-6-7-9-19(16)29(32)33/h6-11,13-14,18H,5,12H2,1-4H3,(H,25,31)