N,N-diethyl-6-(3-nitrophenyl)pyrimidin-4-amine hydrochloride

Systemtic Name: N,N-diethyl-6-(3-nitrophenyl)pyrimidin-4-amine hydrochloride Openeye Name: N,N-diethyl-6-(3-nitrophenyl)pyrimidin-4-amine hydrochloride CAS Name: N,N-diethyl-6-(3-nitrophenyl)-4-pyrimidinamine hydrochloride IUPAC Name: N,N-diethyl-6-(3-nitrophenyl)pyrimidin-4-amine hydrochloride Traditional Name: diethyl-[6-(3-nitrophenyl)pyrimidin-4-yl]amine hydrochloride Formula: C14H17ClN4O2 MolecularWeight: 308.76338

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC=NC(=C1)C2=CC(=CC=C2)[N+](=O)[O-].Cl

Isomeric SMILES

CCN(CC)C1=NC=NC(=C1)C2=CC(=CC=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C14H16N4O2.ClH/c1-3-17(4-2)14-9-13(15-10-16-14)11-6-5-7-12(8-11)18(19)20;/h5-10H,3-4H2,1-2H3;1H