N-[(3,4-dimethoxyphenyl)methyl]-1-[(4-fluorophenyl)methyl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-1-[(4-fluorophenyl)methyl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-1-[(4-fluorophenyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-1-[(4-fluorophenyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-1-[(4-fluorophenyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide Traditional Name: 1-(4-fluorobenzyl)-6-keto-N-veratryl-4,5-dihydropyridazine-3-carboxamide Formula: C21H22FN3O4 MolecularWeight: 399.415483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=NN(C(=O)CC2)CC3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=NN(C(=O)CC2)CC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H22FN3O4/c1-28-18-9-5-15(11-19(18)29-2)12-23-21(27)17-8-10-20(26)25(24-17)13-14-3-6-16(22)7-4-14/h3-7,9,11H,8,10,12-13H2,1-2H3,(H,23,27)