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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O4/c1-3-30-23(29)22-19(24-20(27)14-11-17-7-5-4-6-8-17)15-21(28)26(25-22)18-12-9-16(2)10-13-18/h9-10,12-13,15,17H,3-8,11,14H2,1-2H3,(H,24,27)