N-(2-azanyl-2-oxidanylidene-ethyl)-1-[5-nitro-6-(2-oxidanylidenechromen-7-yl)oxy-pyrimidin-4-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-1-[5-nitro-6-(2-oxidanylidenechromen-7-yl)oxy-pyrimidin-4-yl]pyrrolidine-2-carboxamide Openeye Name: N-(2-amino-2-oxo-ethyl)-1-[5-nitro-6-(2-oxochromen-7-yl)oxy-pyrimidin-4-yl]pyrrolidine-2-carboxamide CAS Name: N-(2-amino-2-oxoethyl)-1-[5-nitro-6-[(2-oxo-1-benzopyran-7-yl)oxy]-4-pyrimidinyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-amino-2-oxoethyl)-1-[5-nitro-6-(2-oxochromen-7-yl)oxypyrimidin-4-yl]pyrrolidine-2-carboxamide Traditional Name: N-(2-amino-2-keto-ethyl)-1-[6-(2-ketochromen-7-yl)oxy-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxamide Formula: C20H18N6O7 MolecularWeight: 454.39292

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C(=NC=N2)OC3=CC4=C(C=C3)C=CC(=O)O4)[N+](=O)[O-])C(=O)NCC(=O)N

Isomeric SMILES

C1CC(N(C1)C2=C(C(=NC=N2)OC3=CC4=C(C=C3)C=CC(=O)O4)[N+](=O)[O-])C(=O)NCC(=O)N

InChI

InChI=1S/C20H18N6O7/c21-15(27)9-22-19(29)13-2-1-7-25(13)18-17(26(30)31)20(24-10-23-18)32-12-5-3-11-4-6-16(28)33-14(11)8-12/h3-6,8,10,13H,1-2,7,9H2,(H2,21,27)(H,22,29)