ethyl 4-[(5-chloranyl-2-nitro-phenyl)carbonylamino]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[(5-chloranyl-2-nitro-phenyl)carbonylamino]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(5-chloro-2-nitro-benzoyl)amino]-6-oxo-1-phenyl-pyridazine-3-carboxylate CAS Name: 4-[[(5-chloro-2-nitrophenyl)-oxomethyl]amino]-6-oxo-1-phenyl-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-chloro-2-nitrobenzoyl)amino]-6-oxo-1-phenylpyridazine-3-carboxylate Traditional Name: 4-[(5-chloro-2-nitro-benzoyl)amino]-6-keto-1-phenyl-pyridazine-3-carboxylic acid ethyl ester Formula: C20H15ClN4O6 MolecularWeight: 442.8093

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H15ClN4O6/c1-2-31-20(28)18-15(11-17(26)24(23-18)13-6-4-3-5-7-13)22-19(27)14-10-12(21)8-9-16(14)25(29)30/h3-11H,2H2,1H3,(H,22,27)