4-[(4R)-5-butoxycarbonyl-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-4-yl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(4R)-5-butoxycarbonyl-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-4-yl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(4R)-5-butoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(4R)-5-[butoxy(oxo)methyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(4R)-5-butoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(4R)-5-butoxycarbonyl-2-keto-6-methyl-3,4-dihydro-1H-pyrimidin-4-yl]-2-methoxy-6-nitro-phenolate Formula: C17H20N3O7- MolecularWeight: 378.3566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-])C

Isomeric SMILES

CCCCOC(=O)C1=C(NC(=O)N[C@@H]1C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C17H21N3O7/c1-4-5-6-27-16(22)13-9(2)18-17(23)19-14(13)10-7-11(20(24)25)15(21)12(8-10)26-3/h7-8,14,21H,4-6H2,1-3H3,(H2,18,19,23)/p-1/t14-/m1/s1