diethyl 2-morpholin-4-yl-4,7-diphenyl-pyrrolo[1,2-b]pyridazine-5,6-dicarboxylate

Systemtic Name: diethyl 2-morpholin-4-yl-4,7-diphenyl-pyrrolo[1,2-b]pyridazine-5,6-dicarboxylate Openeye Name: diethyl 2-morpholino-4,7-diphenyl-pyrrolo[1,2-b]pyridazine-5,6-dicarboxylate CAS Name: 2-(4-morpholinyl)-4,7-diphenylpyrrolo[1,2-b]pyridazine-5,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-morpholin-4-yl-4,7-diphenylpyrrolo[1,2-b]pyridazine-5,6-dicarboxylate Traditional Name: 2-morpholino-4,7-diphenyl-pyrrolo[1,2-b]pyridazine-5,6-dicarboxylic acid diethyl ester Formula: C29H29N3O5 MolecularWeight: 499.55766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C(=C1C(=O)OCC)C(=CC(=N2)N3CCOCC3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(N2C(=C1C(=O)OCC)C(=CC(=N2)N3CCOCC3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H29N3O5/c1-3-36-28(33)24-25(29(34)37-4-2)27-22(20-11-7-5-8-12-20)19-23(31-15-17-35-18-16-31)30-32(27)26(24)21-13-9-6-10-14-21/h5-14,19H,3-4,15-18H2,1-2H3