ethyl 3-cyano-5-methyl-4-(4-phenoxyphenoxy)pyrrolo[1,2-b]pyridazine-6-carboxylate

Systemtic Name: ethyl 3-cyano-5-methyl-4-(4-phenoxyphenoxy)pyrrolo[1,2-b]pyridazine-6-carboxylate Openeye Name: ethyl 3-cyano-5-methyl-4-(4-phenoxyphenoxy)pyrrolo[1,2-b]pyridazine-6-carboxylate CAS Name: 3-cyano-5-methyl-4-(4-phenoxyphenoxy)-6-pyrrolo[1,2-b]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-5-methyl-4-(4-phenoxyphenoxy)pyrrolo[1,2-b]pyridazine-6-carboxylate Traditional Name: 3-cyano-5-methyl-4-(4-phenoxyphenoxy)pyrrolo[1,2-b]pyridazine-6-carboxylic acid ethyl ester Formula: C24H19N3O4 MolecularWeight: 413.42536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2C(=C1C)C(=C(C=N2)C#N)OC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN2C(=C1C)C(=C(C=N2)C#N)OC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C24H19N3O4/c1-3-29-24(28)21-15-27-22(16(21)2)23(17(13-25)14-26-27)31-20-11-9-19(10-12-20)30-18-7-5-4-6-8-18/h4-12,14-15H,3H2,1-2H3