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

Systemtic Name: 2-methoxy-4-[(4S)-5-methoxycarbonyl-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-4-yl]-6-nitro-phenolate Openeye Name: 2-methoxy-4-[(4S)-5-methoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]-6-nitro-phenolate CAS Name: 2-methoxy-4-[(4S)-5-methoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]-6-nitrophenolate IUPAC Name: 2-methoxy-4-[(4S)-5-methoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]-6-nitrophenolate Traditional Name: 4-[(4S)-5-carbomethoxy-2-keto-6-methyl-3,4-dihydro-1H-pyrimidin-4-yl]-2-methoxy-6-nitro-phenolate Formula: C14H14N3O7- MolecularWeight: 336.27686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1)C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H15N3O7/c1-6-10(13(19)24-3)11(16-14(20)15-6)7-4-8(17(21)22)12(18)9(5-7)23-2/h4-5,11,18H,1-3H3,(H2,15,16,20)/p-1/t11-/m0/s1