N-(1-adamantyl)-6-chloranyl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(1-adamantyl)-6-chloranyl-5-nitro-pyrimidin-4-amine Openeye Name: N-(1-adamantyl)-6-chloro-5-nitro-pyrimidin-4-amine CAS Name: N-(1-adamantyl)-6-chloro-5-nitro-4-pyrimidinamine IUPAC Name: N-(1-adamantyl)-6-chloro-5-nitropyrimidin-4-amine Traditional Name: 1-adamantyl-(6-chloro-5-nitro-pyrimidin-4-yl)amine Formula: C14H17ClN4O2 MolecularWeight: 308.76338

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC4=C(C(=NC=N4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC4=C(C(=NC=N4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H17ClN4O2/c15-12-11(19(20)21)13(17-7-16-12)18-14-4-8-1-9(5-14)3-10(2-8)6-14/h7-10H,1-6H2,(H,16,17,18)