(phenylmethyl) 2-[6-oxidanylidene-3-(3,4,5-trimethoxyphenyl)pyridazin-1-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[6-oxidanylidene-3-(3,4,5-trimethoxyphenyl)pyridazin-1-yl]ethanoate Openeye Name: benzyl 2-[6-oxo-3-(3,4,5-trimethoxyphenyl)pyridazin-1-yl]acetate CAS Name: 2-[6-oxo-3-(3,4,5-trimethoxyphenyl)-1-pyridazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[6-oxo-3-(3,4,5-trimethoxyphenyl)pyridazin-1-yl]acetate Traditional Name: 2-[6-keto-3-(3,4,5-trimethoxyphenyl)pyridazin-1-yl]acetic acid benzyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN(C(=O)C=C2)CC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN(C(=O)C=C2)CC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O6/c1-27-18-11-16(12-19(28-2)22(18)29-3)17-9-10-20(25)24(23-17)13-21(26)30-14-15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3