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

Systemtic Name: ethyl 3-cyano-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-7-carboxylate Openeye Name: ethyl 3-cyano-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-7-carboxylate CAS Name: 3-cyano-4-(4-phenoxyanilino)-7-pyrrolo[1,2-b]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-7-carboxylate Traditional Name: 3-cyano-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-7-carboxylic acid ethyl ester Formula: C23H18N4O3 MolecularWeight: 398.41402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C2N1N=CC(=C2NC3=CC=C(C=C3)OC4=CC=CC=C4)C#N

Isomeric SMILES

CCOC(=O)C1=CC=C2N1N=CC(=C2NC3=CC=C(C=C3)OC4=CC=CC=C4)C#N

InChI

InChI=1S/C23H18N4O3/c1-2-29-23(28)21-13-12-20-22(16(14-24)15-25-27(20)21)26-17-8-10-19(11-9-17)30-18-6-4-3-5-7-18/h3-13,15,26H,2H2,1H3