(4Z)-2-(1-adamantyl)-4-[(3,5-dimethoxyphenyl)methylidene]-1,3-oxazol-5-one

Systemtic Name: (4Z)-2-(1-adamantyl)-4-[(3,5-dimethoxyphenyl)methylidene]-1,3-oxazol-5-one Openeye Name: (4Z)-2-(1-adamantyl)-4-[(3,5-dimethoxyphenyl)methylene]oxazol-5-one CAS Name: (4Z)-2-(1-adamantyl)-4-[(3,5-dimethoxyphenyl)methylidene]-5-oxazolone IUPAC Name: (4Z)-2-(1-adamantyl)-4-[(3,5-dimethoxyphenyl)methylidene]-1,3-oxazol-5-one Traditional Name: (4Z)-2-(1-adamantyl)-4-(3,5-dimethoxybenzylidene)-2-oxazolin-5-one Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=C2C(=O)OC(=N2)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)/C=C\2/C(=O)OC(=N2)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C22H25NO4/c1-25-17-6-13(7-18(9-17)26-2)8-19-20(24)27-21(23-19)22-10-14-3-15(11-22)5-16(4-14)12-22/h6-9,14-16H,3-5,10-12H2,1-2H3/b19-8-