2-(1H-benzimidazol-2-yl)-3-(4-butoxy-3-ethoxy-phenyl)-1-morpholin-4-yl-prop-2-en-1-one

Systemtic Name: 2-(1H-benzimidazol-2-yl)-3-(4-butoxy-3-ethoxy-phenyl)-1-morpholin-4-yl-prop-2-en-1-one Openeye Name: 2-(1H-benzimidazol-2-yl)-3-(4-butoxy-3-ethoxy-phenyl)-1-morpholino-prop-2-en-1-one CAS Name: 2-(1H-benzimidazol-2-yl)-3-(4-butoxy-3-ethoxyphenyl)-1-(4-morpholinyl)-2-propen-1-one IUPAC Name: 2-(1H-benzimidazol-2-yl)-3-(4-butoxy-3-ethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one Traditional Name: 2-(1H-benzimidazol-2-yl)-3-(4-butoxy-3-ethoxy-phenyl)-1-morpholino-prop-2-en-1-one Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C(C2=NC3=CC=CC=C3N2)C(=O)N4CCOCC4)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C=C(C2=NC3=CC=CC=C3N2)C(=O)N4CCOCC4)OCC

InChI

InChI=1S/C26H31N3O4/c1-3-5-14-33-23-11-10-19(18-24(23)32-4-2)17-20(26(30)29-12-15-31-16-13-29)25-27-21-8-6-7-9-22(21)28-25/h6-11,17-18H,3-5,12-16H2,1-2H3,(H,27,28)