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

Systemtic Name: (4Z)-2-(1-adamantyl)-4-[(3-phenoxyphenyl)methylidene]-1,3-oxazol-5-one Openeye Name: (4Z)-2-(1-adamantyl)-4-[(3-phenoxyphenyl)methylene]oxazol-5-one CAS Name: (4Z)-2-(1-adamantyl)-4-[(3-phenoxyphenyl)methylidene]-5-oxazolone IUPAC Name: (4Z)-2-(1-adamantyl)-4-[(3-phenoxyphenyl)methylidene]-1,3-oxazol-5-one Traditional Name: (4Z)-2-(1-adamantyl)-4-(3-phenoxybenzylidene)-2-oxazolin-5-one Formula: C26H25NO3 MolecularWeight: 399.4816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NC(=CC5=CC(=CC=C5)OC6=CC=CC=C6)C(=O)O4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=N/C(=C\C5=CC(=CC=C5)OC6=CC=CC=C6)/C(=O)O4

InChI

InChI=1S/C26H25NO3/c28-24-23(13-17-5-4-8-22(12-17)29-21-6-2-1-3-7-21)27-25(30-24)26-14-18-9-19(15-26)11-20(10-18)16-26/h1-8,12-13,18-20H,9-11,14-16H2/b23-13-