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

Systemtic Name: 2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[2-(2-methylbenzimidazol-1-yl)ethyl]ethanamide Openeye Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[2-(2-methylbenzimidazol-1-yl)ethyl]acetamide CAS Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[2-(2-methyl-1-benzimidazolyl)ethyl]acetamide IUPAC Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[2-(2-methylbenzimidazol-1-yl)ethyl]acetamide Traditional Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[2-(2-methylbenzimidazol-1-yl)ethyl]acetamide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CCNC(=O)CC3=CC4=C(C(=C3)Cl)OCCCO4

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CCNC(=O)CC3=CC4=C(C(=C3)Cl)OCCCO4

InChI

InChI=1S/C21H22ClN3O3/c1-14-24-17-5-2-3-6-18(17)25(14)8-7-23-20(26)13-15-11-16(22)21-19(12-15)27-9-4-10-28-21/h2-3,5-6,11-12H,4,7-10,13H2,1H3,(H,23,26)