N-(2-chloranyl-4,5-dimethoxy-phenyl)-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide

Systemtic Name: N-(2-chloranyl-4,5-dimethoxy-phenyl)-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide Openeye Name: 1-benzyl-N-(2-chloro-4,5-dimethoxy-phenyl)-6-oxo-pyridazine-3-carboxamide CAS Name: N-(2-chloro-4,5-dimethoxyphenyl)-6-oxo-1-(phenylmethyl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-N-(2-chloro-4,5-dimethoxyphenyl)-6-oxopyridazine-3-carboxamide Traditional Name: 1-benzyl-N-(2-chloro-4,5-dimethoxy-phenyl)-6-keto-pyridazine-3-carboxamide Formula: C20H18ClN3O4 MolecularWeight: 399.82762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)NC(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C20H18ClN3O4/c1-27-17-10-14(21)16(11-18(17)28-2)22-20(26)15-8-9-19(25)24(23-15)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,22,26)