N-(3-chloranyl-2,6-diethyl-phenyl)-1-(6-chloranylpyridazin-3-yl)piperidine-3-carboxamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-1-(6-chloranylpyridazin-3-yl)piperidine-3-carboxamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-1-(6-chloropyridazin-3-yl)piperidine-3-carboxamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-1-(6-chloro-3-pyridazinyl)-3-piperidinecarboxamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-1-(6-chloropyridazin-3-yl)piperidine-3-carboxamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-1-(6-chloropyridazin-3-yl)nipecotamide Formula: C20H24Cl2N4O MolecularWeight: 407.33676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C20H24Cl2N4O/c1-3-13-7-8-16(21)15(4-2)19(13)23-20(27)14-6-5-11-26(12-14)18-10-9-17(22)24-25-18/h7-10,14H,3-6,11-12H2,1-2H3,(H,23,27)