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

Systemtic Name: 2-[[6-[(5-chloranyl-2-methyl-phenyl)amino]-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol Openeye Name: 2-[[6-(5-chloro-2-methyl-anilino)-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol CAS Name: 2-[[6-(5-chloro-2-methylanilino)-5-nitro-4-pyrimidinyl]-ethylamino]ethanol IUPAC Name: 2-[[6-(5-chloro-2-methylanilino)-5-nitropyrimidin-4-yl]-ethylamino]ethanol Traditional Name: 2-[[6-(5-chloro-2-methyl-anilino)-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol Formula: C15H18ClN5O3 MolecularWeight: 351.78812

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C1=NC=NC(=C1[N+](=O)[O-])NC2=C(C=CC(=C2)Cl)C

Isomeric SMILES

CCN(CCO)C1=NC=NC(=C1[N+](=O)[O-])NC2=C(C=CC(=C2)Cl)C

InChI

InChI=1S/C15H18ClN5O3/c1-3-20(6-7-22)15-13(21(23)24)14(17-9-18-15)19-12-8-11(16)5-4-10(12)2/h4-5,8-9,22H,3,6-7H2,1-2H3,(H,17,18,19)