(4E)-4-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-2-(3-methylphenyl)-1,3-oxazol-5-one

Systemtic Name: (4E)-4-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-2-(3-methylphenyl)-1,3-oxazol-5-one Openeye Name: (4E)-4-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylene]-2-(m-tolyl)oxazol-5-one CAS Name: (4E)-4-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-2-(3-methylphenyl)-5-oxazolone IUPAC Name: (4E)-4-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-2-(3-methylphenyl)-1,3-oxazol-5-one Traditional Name: (4E)-4-(3-methoxy-4-propargyloxy-benzylidene)-2-(m-tolyl)-2-oxazolin-5-one Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CC3=CC(=C(C=C3)OCC#C)OC)C(=O)O2

Isomeric SMILES

CC1=CC=CC(=C1)C2=N/C(=C/C3=CC(=C(C=C3)OCC#C)OC)/C(=O)O2

InChI

InChI=1S/C21H17NO4/c1-4-10-25-18-9-8-15(13-19(18)24-3)12-17-21(23)26-20(22-17)16-7-5-6-14(2)11-16/h1,5-9,11-13H,10H2,2-3H3/b17-12+