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

Systemtic Name: ethyl 1-(4-methylphenyl)-6-oxidanylidene-4-(2-propylpentanoylamino)pyridazine-3-carboxylate Openeye Name: ethyl 6-oxo-4-(2-propylpentanoylamino)-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 1-(4-methylphenyl)-6-oxo-4-[(1-oxo-2-propylpentyl)amino]-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylphenyl)-6-oxo-4-(2-propylpentanoylamino)pyridazine-3-carboxylate Traditional Name: 6-keto-4-(2-propylpentanoylamino)-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C22H29N3O4 MolecularWeight: 399.48336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=CC(=O)N(N=C1C(=O)OCC)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC(CCC)C(=O)NC1=CC(=O)N(N=C1C(=O)OCC)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H29N3O4/c1-5-8-16(9-6-2)21(27)23-18-14-19(26)25(17-12-10-15(4)11-13-17)24-20(18)22(28)29-7-3/h10-14,16H,5-9H2,1-4H3,(H,23,27)