N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)pyrazine-2-carboxamide

Systemtic Name: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)pyrazine-2-carboxamide Openeye Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)pyrazine-2-carboxamide CAS Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-pyrazinecarboxamide IUPAC Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)pyrazine-2-carboxamide Traditional Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)pyrazinamide Formula: C14H12ClN3O3 MolecularWeight: 305.71638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)NC(=O)C3=NC=CN=C3)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)NC(=O)C3=NC=CN=C3)Cl)OC1

InChI

InChI=1S/C14H12ClN3O3/c15-9-6-12-13(21-5-1-4-20-12)7-10(9)18-14(19)11-8-16-2-3-17-11/h2-3,6-8H,1,4-5H2,(H,18,19)