2-[ethyl-[6-[methyl-(phenylmethyl)amino]-5-nitro-pyrimidin-4-yl]amino]ethanol

Systemtic Name: 2-[ethyl-[6-[methyl-(phenylmethyl)amino]-5-nitro-pyrimidin-4-yl]amino]ethanol Openeye Name: 2-[[6-[benzyl(methyl)amino]-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol CAS Name: 2-[ethyl-[6-[methyl-(phenylmethyl)amino]-5-nitro-4-pyrimidinyl]amino]ethanol IUPAC Name: 2-[[6-[benzyl(methyl)amino]-5-nitropyrimidin-4-yl]-ethylamino]ethanol Traditional Name: 2-[[6-[benzyl(methyl)amino]-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C1=NC=NC(=C1[N+](=O)[O-])N(C)CC2=CC=CC=C2

Isomeric SMILES

CCN(CCO)C1=NC=NC(=C1[N+](=O)[O-])N(C)CC2=CC=CC=C2

InChI

InChI=1S/C16H21N5O3/c1-3-20(9-10-22)16-14(21(23)24)15(17-12-18-16)19(2)11-13-7-5-4-6-8-13/h4-8,12,22H,3,9-11H2,1-2H3