(phenylmethyl) 4-(5-chloranyl-6-oxidanylidene-1H-pyridazin-4-yl)piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(5-chloranyl-6-oxidanylidene-1H-pyridazin-4-yl)piperazine-1-carboxylate Openeye Name: benzyl 4-(5-chloro-6-oxo-1H-pyridazin-4-yl)piperazine-1-carboxylate CAS Name: 4-(5-chloro-6-oxo-1H-pyridazin-4-yl)-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(5-chloro-6-oxo-1H-pyridazin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(5-chloro-6-keto-1H-pyridazin-4-yl)piperazine-1-carboxylic acid benzyl ester Formula: C16H17ClN4O3 MolecularWeight: 348.78418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)NN=C2)Cl)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)NN=C2)Cl)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C16H17ClN4O3/c17-14-13(10-18-19-15(14)22)20-6-8-21(9-7-20)16(23)24-11-12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H,19,22)