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

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CC(=O)NCC3=NC4=CC=CC=C4N3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CC(=O)NCC3=NC4=CC=CC=C4N3)Cl)OC1

InChI

InChI=1S/C19H18ClN3O3/c20-13-8-12(9-16-19(13)26-7-3-6-25-16)10-18(24)21-11-17-22-14-4-1-2-5-15(14)23-17/h1-2,4-5,8-9H,3,6-7,10-11H2,(H,21,24)(H,22,23)