ethyl 4-(cyclohexylcarbonylamino)-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-(cyclohexylcarbonylamino)-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-(cyclohexanecarbonylamino)-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 4-[[cyclohexyl(oxo)methyl]amino]-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(cyclohexanecarbonylamino)-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-(cyclohexanecarbonylamino)-6-keto-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2CCCCC2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2CCCCC2)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H25N3O4/c1-3-28-21(27)19-17(22-20(26)15-7-5-4-6-8-15)13-18(25)24(23-19)16-11-9-14(2)10-12-16/h9-13,15H,3-8H2,1-2H3,(H,22,26)