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

Systemtic Name: ethyl 1-[4-[[2-(2-chlorophenyl)-3-oxidanylidene-5-phenoxy-pyridazin-4-yl]amino]phenyl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[4-[[2-(2-chlorophenyl)-3-oxo-5-phenoxy-pyridazin-4-yl]amino]benzoyl]piperidine-3-carboxylate CAS Name: 1-[[4-[[2-(2-chlorophenyl)-3-oxo-5-phenoxy-4-pyridazinyl]amino]phenyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[2-(2-chlorophenyl)-3-oxo-5-phenoxypyridazin-4-yl]amino]benzoyl]piperidine-3-carboxylate Traditional Name: 1-[4-[[2-(2-chlorophenyl)-3-keto-5-phenoxy-pyridazin-4-yl]amino]benzoyl]nipecotic acid ethyl ester Formula: C31H29ClN4O5 MolecularWeight: 573.03876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)NC3=C(C=NN(C3=O)C4=CC=CC=C4Cl)OC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)NC3=C(C=NN(C3=O)C4=CC=CC=C4Cl)OC5=CC=CC=C5

InChI

InChI=1S/C31H29ClN4O5/c1-2-40-31(39)22-9-8-18-35(20-22)29(37)21-14-16-23(17-15-21)34-28-27(41-24-10-4-3-5-11-24)19-33-36(30(28)38)26-13-7-6-12-25(26)32/h3-7,10-17,19,22,34H,2,8-9,18,20H2,1H3