2-[4-[6-[(2-chloranylpyridin-3-yl)amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[6-[(2-chloranylpyridin-3-yl)amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[6-[(2-chloro-3-pyridyl)amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]ethanol CAS Name: 2-[4-[6-[(2-chloro-3-pyridinyl)amino]-5-nitro-4-pyrimidinyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[6-[(2-chloropyridin-3-yl)amino]-5-nitropyrimidin-4-yl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[6-[(2-chloro-3-pyridyl)amino]-5-nitro-pyrimidin-4-yl]piperazino]ethanol Formula: C15H18ClN7O3 MolecularWeight: 379.80152

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=C(C(=NC=N2)NC3=C(N=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCO)C2=C(C(=NC=N2)NC3=C(N=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H18ClN7O3/c16-13-11(2-1-3-17-13)20-14-12(23(25)26)15(19-10-18-14)22-6-4-21(5-7-22)8-9-24/h1-3,10,24H,4-9H2,(H,18,19,20)