(E)-2-(1H-benzimidazol-2-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-morpholin-4-yl-prop-2-en-1-one

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-morpholin-4-yl-prop-2-en-1-one Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-morpholino-prop-2-en-1-one CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-morpholinyl)-2-propen-1-one IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-morpholin-4-ylprop-2-en-1-one Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-morpholino-prop-2-en-1-one Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(=CC2=CC3=C(C=C2)OCCO3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1COCCN1C(=O)/C(=C/C2=CC3=C(C=C2)OCCO3)/C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C22H21N3O4/c26-22(25-7-9-27-10-8-25)16(21-23-17-3-1-2-4-18(17)24-21)13-15-5-6-19-20(14-15)29-12-11-28-19/h1-6,13-14H,7-12H2,(H,23,24)/b16-13+