1-(6-chloranylpyridazin-3-yl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]piperidine-3-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]piperidine-3-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]piperidine-3-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]nipecotamide Formula: C21H27ClN4O3 MolecularWeight: 418.91708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl)OC

InChI

InChI=1S/C21H27ClN4O3/c1-4-29-17-8-7-15(12-18(17)28-3)14(2)23-21(27)16-6-5-11-26(13-16)20-10-9-19(22)24-25-20/h7-10,12,14,16H,4-6,11,13H2,1-3H3,(H,23,27)