ethyl 1-[4-[(2-methyl-3-oxidanylidene-5-phenoxy-pyridazin-4-yl)amino]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-[(2-methyl-3-oxidanylidene-5-phenoxy-pyridazin-4-yl)amino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-[(2-methyl-3-oxo-5-phenoxy-pyridazin-4-yl)amino]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-[(2-methyl-3-oxo-5-phenoxy-4-pyridazinyl)amino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(2-methyl-3-oxo-5-phenoxypyridazin-4-yl)amino]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[(3-keto-2-methyl-5-phenoxy-pyridazin-4-yl)amino]benzoyl]isonipecotic acid ethyl ester Formula: C26H28N4O5 MolecularWeight: 476.52432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=C(C=NN(C3=O)C)OC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=C(C=NN(C3=O)C)OC4=CC=CC=C4

InChI

InChI=1S/C26H28N4O5/c1-3-34-26(33)19-13-15-30(16-14-19)24(31)18-9-11-20(12-10-18)28-23-22(17-27-29(2)25(23)32)35-21-7-5-4-6-8-21/h4-12,17,19,28H,3,13-16H2,1-2H3