1-adamantyl-[3-(4-nitrophenyl)oxiran-2-yl]methanone

Systemtic Name: 1-adamantyl-[3-(4-nitrophenyl)oxiran-2-yl]methanone Openeye Name: 1-adamantyl-[3-(4-nitrophenyl)oxiran-2-yl]methanone CAS Name: 1-adamantyl-[3-(4-nitrophenyl)-2-oxiranyl]methanone IUPAC Name: 1-adamantyl-[3-(4-nitrophenyl)oxiran-2-yl]methanone Traditional Name: 1-adamantyl-[3-(4-nitrophenyl)oxiran-2-yl]methanone Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C4C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)C4C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C19H21NO4/c21-18(19-8-11-5-12(9-19)7-13(6-11)10-19)17-16(24-17)14-1-3-15(4-2-14)20(22)23/h1-4,11-13,16-17H,5-10H2