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

Systemtic Name: (4Z)-2-(1-adamantyl)-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5-one Openeye Name: (4Z)-2-(1-adamantyl)-4-[(3-nitrophenyl)methylene]oxazol-5-one CAS Name: (4Z)-2-(1-adamantyl)-4-[(3-nitrophenyl)methylidene]-5-oxazolone IUPAC Name: (4Z)-2-(1-adamantyl)-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5-one Traditional Name: (4Z)-2-(1-adamantyl)-4-(3-nitrobenzylidene)-2-oxazolin-5-one Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NC(=CC5=CC(=CC=C5)[N+](=O)[O-])C(=O)O4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=N/C(=C\C5=CC(=CC=C5)[N+](=O)[O-])/C(=O)O4

InChI

InChI=1S/C20H20N2O4/c23-18-17(8-12-2-1-3-16(7-12)22(24)25)21-19(26-18)20-9-13-4-14(10-20)6-15(5-13)11-20/h1-3,7-8,13-15H,4-6,9-11H2/b17-8-