N-(2-azanyl-2-oxidanylidene-ethyl)-1-(6-naphthalen-1-yloxy-5-nitro-pyrimidin-4-yl)pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-1-(6-naphthalen-1-yloxy-5-nitro-pyrimidin-4-yl)pyrrolidine-2-carboxamide Openeye Name: N-(2-amino-2-oxo-ethyl)-1-[6-(1-naphthyloxy)-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxamide CAS Name: N-(2-amino-2-oxoethyl)-1-[6-(1-naphthalenyloxy)-5-nitro-4-pyrimidinyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-amino-2-oxoethyl)-1-(6-naphthalen-1-yloxy-5-nitropyrimidin-4-yl)pyrrolidine-2-carboxamide Traditional Name: N-(2-amino-2-keto-ethyl)-1-[6-(1-naphthoxy)-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxamide Formula: C21H20N6O5 MolecularWeight: 436.4207

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C(=NC=N2)OC3=CC=CC4=CC=CC=C43)[N+](=O)[O-])C(=O)NCC(=O)N

Isomeric SMILES

C1CC(N(C1)C2=C(C(=NC=N2)OC3=CC=CC4=CC=CC=C43)[N+](=O)[O-])C(=O)NCC(=O)N

InChI

InChI=1S/C21H20N6O5/c22-17(28)11-23-20(29)15-8-4-10-26(15)19-18(27(30)31)21(25-12-24-19)32-16-9-3-6-13-5-1-2-7-14(13)16/h1-3,5-7,9,12,15H,4,8,10-11H2,(H2,22,28)(H,23,29)