[2-[cyclohexyl(ethyl)amino]-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-1-phenyl-pyridazine-3-carboxylate

Systemtic Name: [2-[cyclohexyl(ethyl)amino]-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-1-phenyl-pyridazine-3-carboxylate Openeye Name: [2-[cyclohexyl(ethyl)amino]-2-oxo-ethyl] 6-methyl-4-oxo-1-phenyl-pyridazine-3-carboxylate CAS Name: 6-methyl-4-oxo-1-phenyl-3-pyridazinecarboxylic acid [2-[cyclohexyl(ethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclohexyl(ethyl)amino]-2-oxoethyl] 6-methyl-4-oxo-1-phenylpyridazine-3-carboxylate Traditional Name: 4-keto-6-methyl-1-phenyl-pyridazine-3-carboxylic acid [2-[cyclohexyl(ethyl)amino]-2-keto-ethyl] ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)COC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3

Isomeric SMILES

CCN(C1CCCCC1)C(=O)COC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O4/c1-3-24(17-10-6-4-7-11-17)20(27)15-29-22(28)21-19(26)14-16(2)25(23-21)18-12-8-5-9-13-18/h5,8-9,12-14,17H,3-4,6-7,10-11,15H2,1-2H3