3-[1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-oxomethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carbonyl)-4-piperidyl]-1H-benzimidazol-2-one Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O)Cl)OC1

InChI

InChI=1S/C22H22ClN3O4/c23-16-12-14(13-19-20(16)30-11-3-10-29-19)21(27)25-8-6-15(7-9-25)26-18-5-2-1-4-17(18)24-22(26)28/h1-2,4-5,12-13,15H,3,6-11H2,(H,24,28)