tert-butyl 2-[[6-(4-ethyl-2-oxidanylidene-chromen-7-yl)oxy-5-nitro-pyrimidin-4-yl]-methyl-amino]ethanoate

Systemtic Name: tert-butyl 2-[[6-(4-ethyl-2-oxidanylidene-chromen-7-yl)oxy-5-nitro-pyrimidin-4-yl]-methyl-amino]ethanoate Openeye Name: tert-butyl 2-[[6-(4-ethyl-2-oxo-chromen-7-yl)oxy-5-nitro-pyrimidin-4-yl]-methyl-amino]acetate CAS Name: 2-[[6-[(4-ethyl-2-oxo-1-benzopyran-7-yl)oxy]-5-nitro-4-pyrimidinyl]-methylamino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[6-(4-ethyl-2-oxochromen-7-yl)oxy-5-nitropyrimidin-4-yl]-methylamino]acetate Traditional Name: 2-[[6-(4-ethyl-2-keto-chromen-7-yl)oxy-5-nitro-pyrimidin-4-yl]-methyl-amino]acetic acid tert-butyl ester Formula: C22H24N4O7 MolecularWeight: 456.44856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OC3=NC=NC(=C3[N+](=O)[O-])N(C)CC(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OC3=NC=NC(=C3[N+](=O)[O-])N(C)CC(=O)OC(C)(C)C

InChI

InChI=1S/C22H24N4O7/c1-6-13-9-17(27)32-16-10-14(7-8-15(13)16)31-21-19(26(29)30)20(23-12-24-21)25(5)11-18(28)33-22(2,3)4/h7-10,12H,6,11H2,1-5H3