2-chloranyl-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]pyridine-4-carboxamide

Systemtic Name: 2-chloranyl-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]pyridine-4-carboxamide Openeye Name: 2-chloro-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]pyridine-4-carboxamide CAS Name: 2-chloro-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-pyridinecarboxamide IUPAC Name: 2-chloro-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]pyridine-4-carboxamide Traditional Name: 2-chloro-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]isonicotinamide Formula: C17H17ClN2O3 MolecularWeight: 332.78148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3=CC(=NC=C3)Cl

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3=CC(=NC=C3)Cl

InChI

InChI=1S/C17H17ClN2O3/c1-11(20-17(21)13-5-6-19-16(18)10-13)12-3-4-14-15(9-12)23-8-2-7-22-14/h3-6,9-11H,2,7-8H2,1H3,(H,20,21)