methyl 3-cyano-5-methyl-4-[[4-[2-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxidanylidene-propan-2-yl]oxyphenoxy]phenyl]amino]pyrrolo[1,2-b]pyridazine-6-carboxylate

Systemtic Name: methyl 3-cyano-5-methyl-4-[[4-[2-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxidanylidene-propan-2-yl]oxyphenoxy]phenyl]amino]pyrrolo[1,2-b]pyridazine-6-carboxylate Openeye Name: methyl 4-[4-[2-(2-tert-butoxy-1,1-dimethyl-2-oxo-ethoxy)phenoxy]anilino]-3-cyano-5-methyl-pyrrolo[1,2-b]pyridazine-6-carboxylate CAS Name: 3-cyano-5-methyl-4-[4-[2-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyphenoxy]anilino]-6-pyrrolo[1,2-b]pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 3-cyano-5-methyl-4-[4-[2-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]oxyphenoxy]anilino]pyrrolo[1,2-b]pyridazine-6-carboxylate Traditional Name: 4-[4-[2-(2-tert-butoxy-2-keto-1,1-dimethyl-ethoxy)phenoxy]anilino]-3-cyano-5-methyl-pyrrolo[1,2-b]pyridazine-6-carboxylic acid methyl ester Formula: C31H32N4O6 MolecularWeight: 556.60898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=NN2C=C1C(=O)OC)C#N)NC3=CC=C(C=C3)OC4=CC=CC=C4OC(C)(C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C2C(=C(C=NN2C=C1C(=O)OC)C#N)NC3=CC=C(C=C3)OC4=CC=CC=C4OC(C)(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C31H32N4O6/c1-19-23(28(36)38-7)18-35-27(19)26(20(16-32)17-33-35)34-21-12-14-22(15-13-21)39-24-10-8-9-11-25(24)40-31(5,6)29(37)41-30(2,3)4/h8-15,17-18,34H,1-7H3