4-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-phenoxyphenyl)butanamide

Systemtic Name: 4-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-phenoxyphenyl)butanamide Openeye Name: 4-[3-(4-methoxyphenyl)-6-oxo-pyridazin-1-yl]-N-(4-phenoxyphenyl)butanamide CAS Name: 4-[3-(4-methoxyphenyl)-6-oxo-1-pyridazinyl]-N-(4-phenoxyphenyl)butanamide IUPAC Name: 4-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]-N-(4-phenoxyphenyl)butanamide Traditional Name: 4-[6-keto-3-(4-methoxyphenyl)pyridazin-1-yl]-N-(4-phenoxyphenyl)butyramide Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O4/c1-33-22-13-9-20(10-14-22)25-17-18-27(32)30(29-25)19-5-8-26(31)28-21-11-15-24(16-12-21)34-23-6-3-2-4-7-23/h2-4,6-7,9-18H,5,8,19H2,1H3,(H,28,31)