methyl 2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]carbonylbenzoate

Systemtic Name: methyl 2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]carbonylbenzoate Openeye Name: methyl 2-[4-(6-methoxypyridazin-3-yl)piperazine-1-carbonyl]benzoate CAS Name: 2-[[4-(6-methoxy-3-pyridazinyl)-1-piperazinyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(6-methoxypyridazin-3-yl)piperazine-1-carbonyl]benzoate Traditional Name: 2-[4-(6-methoxypyridazin-3-yl)piperazine-1-carbonyl]benzoic acid methyl ester Formula: C18H20N4O4 MolecularWeight: 356.3758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

COC1=NN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C18H20N4O4/c1-25-16-8-7-15(19-20-16)21-9-11-22(12-10-21)17(23)13-5-3-4-6-14(13)18(24)26-2/h3-8H,9-12H2,1-2H3