N-(2-azanyl-2-oxidanylidene-ethyl)-1-[6-(4-ethanoyl-2,6-dimethoxy-phenoxy)-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-1-[6-(4-ethanoyl-2,6-dimethoxy-phenoxy)-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxamide Openeye Name: 1-[6-(4-acetyl-2,6-dimethoxy-phenoxy)-5-nitro-pyrimidin-4-yl]-N-(2-amino-2-oxo-ethyl)pyrrolidine-2-carboxamide CAS Name: 1-[6-(4-acetyl-2,6-dimethoxyphenoxy)-5-nitro-4-pyrimidinyl]-N-(2-amino-2-oxoethyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-[6-(4-acetyl-2,6-dimethoxyphenoxy)-5-nitropyrimidin-4-yl]-N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide Traditional Name: 1-[6-(4-acetyl-2,6-dimethoxy-phenoxy)-5-nitro-pyrimidin-4-yl]-N-(2-amino-2-keto-ethyl)pyrrolidine-2-carboxamide Formula: C21H24N6O8 MolecularWeight: 488.45066

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C(=C1)OC)OC2=NC=NC(=C2[N+](=O)[O-])N3CCCC3C(=O)NCC(=O)N)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C(=C1)OC)OC2=NC=NC(=C2[N+](=O)[O-])N3CCCC3C(=O)NCC(=O)N)OC

InChI

InChI=1S/C21H24N6O8/c1-11(28)12-7-14(33-2)18(15(8-12)34-3)35-21-17(27(31)32)19(24-10-25-21)26-6-4-5-13(26)20(30)23-9-16(22)29/h7-8,10,13H,4-6,9H2,1-3H3,(H2,22,29)(H,23,30)