N-(2,5-dimethyl-1-adamantyl)-5-nitro-pyridin-2-amine

Systemtic Name: N-(2,5-dimethyl-1-adamantyl)-5-nitro-pyridin-2-amine Openeye Name: N-(2,5-dimethyl-1-adamantyl)-5-nitro-pyridin-2-amine CAS Name: N-(2,5-dimethyl-1-adamantyl)-5-nitro-2-pyridinamine IUPAC Name: N-(2,5-dimethyl-1-adamantyl)-5-nitropyridin-2-amine Traditional Name: (2,5-dimethyl-1-adamantyl)-(5-nitro-2-pyridyl)amine Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC3CC(C2)(CC1(C3)NC4=NC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1C2CC3CC(C2)(CC1(C3)NC4=NC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C17H23N3O2/c1-11-13-5-12-6-16(2,8-13)10-17(11,7-12)19-15-4-3-14(9-18-15)20(21)22/h3-4,9,11-13H,5-8,10H2,1-2H3,(H,18,19)