2-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]carbonylamino]-1-methyl-imidazol-4-olate

Systemtic Name: 2-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]carbonylamino]-1-methyl-imidazol-4-olate Openeye Name: 2-[[(2R)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino]-1-methyl-imidazol-4-olate CAS Name: 2-[[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]-oxomethyl]amino]-1-methyl-4-imidazololate IUPAC Name: 2-[[(2R)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino]-1-methylimidazol-4-olate Traditional Name: 2-[[(2R)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino]-1-methyl-imidazol-4-olate Formula: C13H13N4O3- MolecularWeight: 273.26732

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1NC(=O)C2CNC3=CC=CC=C3O2)[O-]

Isomeric SMILES

CN1C=C(N=C1NC(=O)[C@H]2CNC3=CC=CC=C3O2)[O-]

InChI

InChI=1S/C13H14N4O3/c1-17-7-11(18)15-13(17)16-12(19)10-6-14-8-4-2-3-5-9(8)20-10/h2-5,7,10,14,18H,6H2,1H3,(H,15,16,19)/p-1/t10-/m1/s1