2-azanyl-6-chloranyl-5-nitro-1H-pyrimidin-4-one; N,N-diethylethanamine

Systemtic Name: 2-azanyl-6-chloranyl-5-nitro-1H-pyrimidin-4-one; N,N-diethylethanamine Openeye Name: 2-amino-6-chloro-5-nitro-1H-pyrimidin-4-one; N,N-diethylethanamine CAS Name: 2-amino-6-chloro-5-nitro-1H-pyrimidin-4-one; N,N-diethylethanamine IUPAC Name: 2-amino-6-chloro-5-nitro-1H-pyrimidin-4-one; N,N-diethylethanamine Traditional Name: 2-amino-6-chloro-5-nitro-1H-pyrimidin-4-one; triethylamine Formula: C10H18ClN5O3 MolecularWeight: 291.73462

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.C1(=C(NC(=NC1=O)N)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CC.C1(=C(NC(=NC1=O)N)Cl)[N+](=O)[O-]

InChI

InChI=1S/C6H15N.C4H3ClN4O3/c1-4-7(5-2)6-3;5-2-1(9(11)12)3(10)8-4(6)7-2/h4-6H2,1-3H3;(H3,6,7,8,10)