N-[6-(1H-benzimidazol-2-ylamino)-6-oxidanylidene-hexyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[6-(1H-benzimidazol-2-ylamino)-6-oxidanylidene-hexyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[6-(1H-benzimidazol-2-ylamino)-6-oxo-hexyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[6-(1H-benzimidazol-2-ylamino)-6-oxohexyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[6-(1H-benzimidazol-2-ylamino)-6-oxohexyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[6-(1H-benzimidazol-2-ylamino)-6-keto-hexyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NCCCCCC(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C(=O)NCCCCCC(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H24N4O4/c27-20(26-22-24-15-8-3-4-9-16(15)25-22)12-2-1-7-13-23-21(28)19-14-29-17-10-5-6-11-18(17)30-19/h3-6,8-11,19H,1-2,7,12-14H2,(H,23,28)(H2,24,25,26,27)