N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[(5-nitro-6-oxidanylidene-1H-pyrimidin-4-yl)oxy]ethanamide

Systemtic Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[(5-nitro-6-oxidanylidene-1H-pyrimidin-4-yl)oxy]ethanamide Openeye Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[(5-nitro-6-oxo-1H-pyrimidin-4-yl)oxy]acetamide CAS Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[(5-nitro-6-oxo-1H-pyrimidin-4-yl)oxy]acetamide IUPAC Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[(5-nitro-6-oxo-1H-pyrimidin-4-yl)oxy]acetamide Traditional Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[(6-keto-5-nitro-1H-pyrimidin-4-yl)oxy]acetamide Formula: C16H18N4O5 MolecularWeight: 346.33792

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=O)COC2=C(C(=O)NC=N2)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C)NC(=O)COC2=C(C(=O)NC=N2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O5/c1-3-11-4-6-12(7-5-11)10(2)19-13(21)8-25-16-14(20(23)24)15(22)17-9-18-16/h4-7,9-10H,3,8H2,1-2H3,(H,19,21)(H,17,18,22)/t10-/m0/s1