propan-2-yl 3-(2-nitrophenyl)-3-[[6-oxidanylidene-1-(2-phenoxyethyl)pyridazin-3-yl]carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-(2-nitrophenyl)-3-[[6-oxidanylidene-1-(2-phenoxyethyl)pyridazin-3-yl]carbonylamino]propanoate Openeye Name: isopropyl 3-(2-nitrophenyl)-3-[[6-oxo-1-(2-phenoxyethyl)pyridazine-3-carbonyl]amino]propanoate CAS Name: 3-(2-nitrophenyl)-3-[[oxo-[6-oxo-1-(2-phenoxyethyl)-3-pyridazinyl]methyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-nitrophenyl)-3-[[6-oxo-1-(2-phenoxyethyl)pyridazine-3-carbonyl]amino]propanoate Traditional Name: 3-[[6-keto-1-(2-phenoxyethyl)pyridazine-3-carbonyl]amino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C25H26N4O7 MolecularWeight: 494.49654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3

InChI

InChI=1S/C25H26N4O7/c1-17(2)36-24(31)16-21(19-10-6-7-11-22(19)29(33)34)26-25(32)20-12-13-23(30)28(27-20)14-15-35-18-8-4-3-5-9-18/h3-13,17,21H,14-16H2,1-2H3,(H,26,32)