(5R,7S)-3-(4-nitro-1H-pyrazol-5-yl)adamantan-1-ol

Systemtic Name: (5R,7S)-3-(4-nitro-1H-pyrazol-5-yl)adamantan-1-ol Openeye Name: (5R,7S)-3-(4-nitro-1H-pyrazol-5-yl)adamantan-1-ol CAS Name: (5R,7S)-3-(4-nitro-1H-pyrazol-5-yl)-1-adamantanol IUPAC Name: (5R,7S)-3-(4-nitro-1H-pyrazol-5-yl)adamantan-1-ol Traditional Name: (5R,7S)-3-(4-nitro-1H-pyrazol-5-yl)adamantan-1-ol Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C4=C(C=NN4)[N+](=O)[O-]

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)O)C4=C(C=NN4)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O3/c17-13-4-8-1-9(5-13)3-12(2-8,7-13)11-10(16(18)19)6-14-15-11/h6,8-9,17H,1-5,7H2,(H,14,15)/t8-,9+,12?,13?