(3R,5S)-4-(nitromethylidene)-1-phenyl-adamantane

Systemtic Name: (3R,5S)-4-(nitromethylidene)-1-phenyl-adamantane Openeye Name: (3R,5S)-4-(nitromethylene)-1-phenyl-adamantane CAS Name: (3R,5S)-4-(nitromethylidene)-1-phenyladamantane IUPAC Name: (3R,5S)-4-(nitromethylidene)-1-phenyladamantane Traditional Name: (3R,5S)-4-(nitromethylene)-1-phenyl-adamantane Formula: C17H19NO2 MolecularWeight: 269.33826

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC(C2)(CC1C3=C[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1[C@@H]2CC3(C[C@@H](C2=C[N+](=O)[O-])CC1C3)C4=CC=CC=C4

InChI

InChI=1S/C17H19NO2/c19-18(20)11-16-13-6-12-7-14(16)10-17(8-12,9-13)15-4-2-1-3-5-15/h1-5,11-14H,6-10H2/t12?,13-,14+,17?