(2E)-2-[[3-(3-imidazol-1-ylpropoxy)-4-methoxy-phenyl]methylidene]-3H-inden-1-one

Systemtic Name: (2E)-2-[[3-(3-imidazol-1-ylpropoxy)-4-methoxy-phenyl]methylidene]-3H-inden-1-one Openeye Name: (2E)-2-[[3-(3-imidazol-1-ylpropoxy)-4-methoxy-phenyl]methylene]indan-1-one CAS Name: (2E)-2-[[3-[3-(1-imidazolyl)propoxy]-4-methoxyphenyl]methylidene]-3H-inden-1-one IUPAC Name: (2E)-2-[[3-(3-imidazol-1-ylpropoxy)-4-methoxyphenyl]methylidene]-3H-inden-1-one Traditional Name: (2E)-2-[3-(3-imidazol-1-ylpropoxy)-4-methoxy-benzylidene]indan-1-one Formula: C23H22N2O3 MolecularWeight: 374.43238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2CC3=CC=CC=C3C2=O)OCCCN4C=CN=C4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/2\CC3=CC=CC=C3C2=O)OCCCN4C=CN=C4

InChI

InChI=1S/C23H22N2O3/c1-27-21-8-7-17(13-19-15-18-5-2-3-6-20(18)23(19)26)14-22(21)28-12-4-10-25-11-9-24-16-25/h2-3,5-9,11,13-14,16H,4,10,12,15H2,1H3/b19-13+