3-cyano-5-methyl-4-[(4-phenoxyphenyl)carbonylamino]pyrrolo[1,2-b]pyridazine-6-carboxylic acid

Systemtic Name: 3-cyano-5-methyl-4-[(4-phenoxyphenyl)carbonylamino]pyrrolo[1,2-b]pyridazine-6-carboxylic acid Openeye Name: 3-cyano-5-methyl-4-[(4-phenoxybenzoyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylic acid CAS Name: 3-cyano-5-methyl-4-[[oxo-(4-phenoxyphenyl)methyl]amino]-6-pyrrolo[1,2-b]pyridazinecarboxylic acid IUPAC Name: 3-cyano-5-methyl-4-[(4-phenoxybenzoyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylic acid Traditional Name: 3-cyano-5-methyl-4-[(4-phenoxybenzoyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylic acid Formula: C23H16N4O4 MolecularWeight: 412.39754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=NN2C=C1C(=O)O)C#N)NC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=C(C=NN2C=C1C(=O)O)C#N)NC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H16N4O4/c1-14-19(23(29)30)13-27-21(14)20(16(11-24)12-25-27)26-22(28)15-7-9-18(10-8-15)31-17-5-3-2-4-6-17/h2-10,12-13H,1H3,(H,26,28)(H,29,30)