methyl 2-[5-chloranyl-4-[(2,3-dimethoxyphenyl)methyl-methyl-amino]-6-oxidanylidene-pyridazin-1-yl]benzoate

Systemtic Name: methyl 2-[5-chloranyl-4-[(2,3-dimethoxyphenyl)methyl-methyl-amino]-6-oxidanylidene-pyridazin-1-yl]benzoate Openeye Name: methyl 2-[5-chloro-4-[(2,3-dimethoxyphenyl)methyl-methyl-amino]-6-oxo-pyridazin-1-yl]benzoate CAS Name: 2-[5-chloro-4-[(2,3-dimethoxyphenyl)methyl-methylamino]-6-oxo-1-pyridazinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-chloro-4-[(2,3-dimethoxyphenyl)methyl-methylamino]-6-oxopyridazin-1-yl]benzoate Traditional Name: 2-[5-chloro-6-keto-4-[methyl(o-veratryl)amino]pyridazin-1-yl]benzoic acid methyl ester Formula: C22H22ClN3O5 MolecularWeight: 443.88018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C(=CC=C1)OC)OC)C2=C(C(=O)N(N=C2)C3=CC=CC=C3C(=O)OC)Cl

Isomeric SMILES

CN(CC1=C(C(=CC=C1)OC)OC)C2=C(C(=O)N(N=C2)C3=CC=CC=C3C(=O)OC)Cl

InChI

InChI=1S/C22H22ClN3O5/c1-25(13-14-8-7-11-18(29-2)20(14)30-3)17-12-24-26(21(27)19(17)23)16-10-6-5-9-15(16)22(28)31-4/h5-12H,13H2,1-4H3