1-adamantyl-(5-nitro-1-benzofuran-2-yl)methanone

Systemtic Name: 1-adamantyl-(5-nitro-1-benzofuran-2-yl)methanone Openeye Name: 1-adamantyl-(5-nitrobenzofuran-2-yl)methanone CAS Name: 1-adamantyl-(5-nitro-2-benzofuranyl)methanone IUPAC Name: 1-adamantyl-(5-nitro-1-benzofuran-2-yl)methanone Traditional Name: 1-adamantyl-(5-nitrobenzofuran-2-yl)methanone Formula: C19H19NO4 MolecularWeight: 325.35846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19NO4/c21-18(19-8-11-3-12(9-19)5-13(4-11)10-19)17-7-14-6-15(20(22)23)1-2-16(14)24-17/h1-2,6-7,11-13H,3-5,8-10H2