N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(3-oxidanylidenepiperazin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(3-oxidanylidenepiperazin-1-yl)pyridine-3-carboxamide Openeye Name: N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide CAS Name: N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(3-oxo-1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(3-oxopiperazin-1-yl)pyridine-3-carboxamide Traditional Name: N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(3-ketopiperazino)nicotinamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)C(=O)NCCC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)C(=O)NCCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H22N4O4/c25-19-12-24(10-9-21-19)18-6-5-14(11-23-18)20(26)22-8-7-15-13-27-16-3-1-2-4-17(16)28-15/h1-6,11,15H,7-10,12-13H2,(H,21,25)(H,22,26)