N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CC(=O)NCCC3=NC4=CC=CC=C4N3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CC(=O)NCCC3=NC4=CC=CC=C4N3)Cl)OC1

InChI

InChI=1S/C20H20ClN3O3/c21-14-10-13(11-17-20(14)27-9-3-8-26-17)12-19(25)22-7-6-18-23-15-4-1-2-5-16(15)24-18/h1-2,4-5,10-11H,3,6-9,12H2,(H,22,25)(H,23,24)