methyl 1-[[1-(2,5-dimethylphenyl)-6-oxidanylidene-4,5-dihydropyridazin-3-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[1-(2,5-dimethylphenyl)-6-oxidanylidene-4,5-dihydropyridazin-3-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[1-(2,5-dimethylphenyl)-6-oxo-4,5-dihydropyridazine-3-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[1-(2,5-dimethylphenyl)-6-oxo-4,5-dihydropyridazin-3-yl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[1-(2,5-dimethylphenyl)-6-oxo-4,5-dihydropyridazine-3-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[1-(2,5-dimethylphenyl)-6-keto-4,5-dihydropyridazine-3-carbonyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)NC3(CCCCC3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)NC3(CCCCC3)C(=O)OC

InChI

InChI=1S/C21H27N3O4/c1-14-7-8-15(2)17(13-14)24-18(25)10-9-16(23-24)19(26)22-21(20(27)28-3)11-5-4-6-12-21/h7-8,13H,4-6,9-12H2,1-3H3,(H,22,26)