5-methoxy-6-oxidanyl-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-3-carbonitrile

Systemtic Name: 5-methoxy-6-oxidanyl-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-3-carbonitrile Openeye Name: 6-hydroxy-5-methoxy-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-3-carbonitrile CAS Name: 6-hydroxy-5-methoxy-4-(4-phenoxyanilino)-3-pyrrolo[1,2-b]pyridazinecarbonitrile IUPAC Name: 6-hydroxy-5-methoxy-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-3-carbonitrile Traditional Name: 6-hydroxy-5-methoxy-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-3-carbonitrile Formula: C21H16N4O3 MolecularWeight: 372.37674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=NN2C=C1O)C#N)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=NN2C=C1O)C#N)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C21H16N4O3/c1-27-21-18(26)13-25-20(21)19(14(11-22)12-23-25)24-15-7-9-17(10-8-15)28-16-5-3-2-4-6-16/h2-10,12-13,24,26H,1H3