3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-piperidyl]-1H-benzimidazol-2-one Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O5S/c25-21-22-17-4-1-2-5-18(17)24(21)15-8-10-23(11-9-15)30(26,27)16-6-7-19-20(14-16)29-13-3-12-28-19/h1-2,4-7,14-15H,3,8-13H2,(H,22,25)