ethyl 4-(3-cyclohexylpropanoylamino)-1-(2-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-(3-cyclohexylpropanoylamino)-1-(2-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-(3-cyclohexylpropanoylamino)-1-(o-tolyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-[(3-cyclohexyl-1-oxopropyl)amino]-1-(2-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-cyclohexylpropanoylamino)-1-(2-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-(3-cyclohexylpropanoylamino)-6-keto-1-(o-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CCC2CCCCC2)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CCC2CCCCC2)C3=CC=CC=C3C

InChI

InChI=1S/C23H29N3O4/c1-3-30-23(29)22-18(24-20(27)14-13-17-10-5-4-6-11-17)15-21(28)26(25-22)19-12-8-7-9-16(19)2/h7-9,12,15,17H,3-6,10-11,13-14H2,1-2H3,(H,24,27)