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

Systemtic Name: tert-butyl 2-[[6-[4-(methoxymethyl)-2-oxidanylidene-chromen-7-yl]oxy-5-nitro-pyrimidin-4-yl]-methyl-amino]ethanoate Openeye Name: tert-butyl 2-[[6-[4-(methoxymethyl)-2-oxo-chromen-7-yl]oxy-5-nitro-pyrimidin-4-yl]-methyl-amino]acetate CAS Name: 2-[[6-[[4-(methoxymethyl)-2-oxo-1-benzopyran-7-yl]oxy]-5-nitro-4-pyrimidinyl]-methylamino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[6-[4-(methoxymethyl)-2-oxochromen-7-yl]oxy-5-nitropyrimidin-4-yl]-methylamino]acetate Traditional Name: 2-[[6-[2-keto-4-(methoxymethyl)chromen-7-yl]oxy-5-nitro-pyrimidin-4-yl]-methyl-amino]acetic acid tert-butyl ester Formula: C22H24N4O8 MolecularWeight: 472.44796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(C)C1=C(C(=NC=N1)OC2=CC3=C(C=C2)C(=CC(=O)O3)COC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)CN(C)C1=C(C(=NC=N1)OC2=CC3=C(C=C2)C(=CC(=O)O3)COC)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O8/c1-22(2,3)34-18(28)10-25(4)20-19(26(29)30)21(24-12-23-20)32-14-6-7-15-13(11-31-5)8-17(27)33-16(15)9-14/h6-9,12H,10-11H2,1-5H3