2-(1H-benzimidazol-2-yl)-3-(3-chloranyl-4,5-dimethoxy-phenyl)-1-morpholin-4-yl-prop-2-en-1-one

Systemtic Name: 2-(1H-benzimidazol-2-yl)-3-(3-chloranyl-4,5-dimethoxy-phenyl)-1-morpholin-4-yl-prop-2-en-1-one Openeye Name: 2-(1H-benzimidazol-2-yl)-3-(3-chloro-4,5-dimethoxy-phenyl)-1-morpholino-prop-2-en-1-one CAS Name: 2-(1H-benzimidazol-2-yl)-3-(3-chloro-4,5-dimethoxyphenyl)-1-(4-morpholinyl)-2-propen-1-one IUPAC Name: 2-(1H-benzimidazol-2-yl)-3-(3-chloro-4,5-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one Traditional Name: 2-(1H-benzimidazol-2-yl)-3-(3-chloro-4,5-dimethoxy-phenyl)-1-morpholino-prop-2-en-1-one Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C2=NC3=CC=CC=C3N2)C(=O)N4CCOCC4)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C(C2=NC3=CC=CC=C3N2)C(=O)N4CCOCC4)Cl)OC

InChI

InChI=1S/C22H22ClN3O4/c1-28-19-13-14(12-16(23)20(19)29-2)11-15(22(27)26-7-9-30-10-8-26)21-24-17-5-3-4-6-18(17)25-21/h3-6,11-13H,7-10H2,1-2H3,(H,24,25)