1-(6-chloranylpyridazin-3-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-3-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-3-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-3-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-3-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)nipecotamide Formula: C19H21ClN4O3 MolecularWeight: 388.84804

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NN=C(C=C2)Cl)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CC(CN(C1)C2=NN=C(C=C2)Cl)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C19H21ClN4O3/c20-17-6-7-18(23-22-17)24-8-1-3-13(12-24)19(25)21-14-4-5-15-16(11-14)27-10-2-9-26-15/h4-7,11,13H,1-3,8-10,12H2,(H,21,25)