6-(5-chloranyl-2-methoxy-phenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-3-carboxamide

Systemtic Name: 6-(5-chloranyl-2-methoxy-phenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-3-carboxamide Openeye Name: 6-(5-chloro-2-methoxy-phenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-3-carboxamide CAS Name: 6-(5-chloro-2-methoxyphenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-pyridinecarboxamide IUPAC Name: 6-(5-chloro-2-methoxyphenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-3-carboxamide Traditional Name: 6-(5-chloro-2-methoxy-phenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)nicotinamide Formula: C22H19ClN2O4 MolecularWeight: 410.85026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H19ClN2O4/c1-27-19-7-4-15(23)11-17(19)18-6-3-14(13-24-18)22(26)25-16-5-8-20-21(12-16)29-10-2-9-28-20/h3-8,11-13H,2,9-10H2,1H3,(H,25,26)