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

Systemtic Name: 2-[ethyl-[6-[(2-methoxy-5-methyl-phenyl)amino]-5-nitro-pyrimidin-4-yl]amino]ethanol Openeye Name: 2-[ethyl-[6-(2-methoxy-5-methyl-anilino)-5-nitro-pyrimidin-4-yl]amino]ethanol CAS Name: 2-[ethyl-[6-(2-methoxy-5-methylanilino)-5-nitro-4-pyrimidinyl]amino]ethanol IUPAC Name: 2-[ethyl-[6-(2-methoxy-5-methylanilino)-5-nitropyrimidin-4-yl]amino]ethanol Traditional Name: 2-[ethyl-[6-(2-methoxy-5-methyl-anilino)-5-nitro-pyrimidin-4-yl]amino]ethanol Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O4/c1-4-20(7-8-22)16-14(21(23)24)15(17-10-18-16)19-12-9-11(2)5-6-13(12)25-3/h5-6,9-10,22H,4,7-8H2,1-3H3,(H,17,18,19)