6-chloranyl-N-(3-methylbutyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-chloranyl-N-(3-methylbutyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-chloro-N-isopentyl-5-nitro-pyrimidin-4-amine CAS Name: 6-chloro-N-(3-methylbutyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-chloro-N-(3-methylbutyl)-5-nitropyrimidin-4-amine Traditional Name: (6-chloro-5-nitro-pyrimidin-4-yl)-isoamyl-amine Formula: C9H13ClN4O2 MolecularWeight: 244.67812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C(=NC=N1)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNC1=C(C(=NC=N1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C9H13ClN4O2/c1-6(2)3-4-11-9-7(14(15)16)8(10)12-5-13-9/h5-6H,3-4H2,1-2H3,(H,11,12,13)