3-cyano-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-7-carboxylic acid

Systemtic Name: 3-cyano-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-7-carboxylic acid Openeye Name: 3-cyano-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-7-carboxylic acid CAS Name: 3-cyano-4-(4-phenoxyanilino)-7-pyrrolo[1,2-b]pyridazinecarboxylic acid IUPAC Name: 3-cyano-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-7-carboxylic acid Traditional Name: 3-cyano-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-7-carboxylic acid Formula: C21H14N4O3 MolecularWeight: 370.36086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=C(C=NN4C3=CC=C4C(=O)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=C(C=NN4C3=CC=C4C(=O)O)C#N

InChI

InChI=1S/C21H14N4O3/c22-12-14-13-23-25-18(10-11-19(25)21(26)27)20(14)24-15-6-8-17(9-7-15)28-16-4-2-1-3-5-16/h1-11,13,24H,(H,26,27)