N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]quinoxaline-2-carboxamide

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]quinoxaline-2-carboxamide Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]quinoxaline-2-carboxamide CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-quinoxalinecarboxamide IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]quinoxaline-2-carboxamide Traditional Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]quinoxaline-2-carboxamide Formula: C19H16ClN3O3 MolecularWeight: 369.80164

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNC(=O)C3=NC4=CC=CC=C4N=C3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNC(=O)C3=NC4=CC=CC=C4N=C3)Cl)OC1

InChI

InChI=1S/C19H16ClN3O3/c20-13-8-12(9-17-18(13)26-7-3-6-25-17)10-22-19(24)16-11-21-14-4-1-2-5-15(14)23-16/h1-2,4-5,8-9,11H,3,6-7,10H2,(H,22,24)