methyl (2S)-2-[[5-methyl-6-(1,2-oxazol-5-ylcarbonylamino)-4-oxidanylidene-3,1-benzoxazin-2-yl]amino]propanoate

Systemtic Name: methyl (2S)-2-[[5-methyl-6-(1,2-oxazol-5-ylcarbonylamino)-4-oxidanylidene-3,1-benzoxazin-2-yl]amino]propanoate Openeye Name: methyl (2S)-2-[[6-(isoxazole-5-carbonylamino)-5-methyl-4-oxo-3,1-benzoxazin-2-yl]amino]propanoate CAS Name: (2S)-2-[[6-[[5-isoxazolyl(oxo)methyl]amino]-5-methyl-4-oxo-3,1-benzoxazin-2-yl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-methyl-6-(1,2-oxazole-5-carbonylamino)-4-oxo-3,1-benzoxazin-2-yl]amino]propanoate Traditional Name: (2S)-2-[[6-(isoxazole-5-carbonylamino)-4-keto-5-methyl-3,1-benzoxazin-2-yl]amino]propionic acid methyl ester Formula: C17H16N4O6 MolecularWeight: 372.33214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)NC(C)C(=O)OC)NC(=O)C3=CC=NO3

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N[C@@H](C)C(=O)OC)NC(=O)C3=CC=NO3

InChI

InChI=1S/C17H16N4O6/c1-8-10(20-14(22)12-6-7-18-27-12)4-5-11-13(8)16(24)26-17(21-11)19-9(2)15(23)25-3/h4-7,9H,1-3H3,(H,19,21)(H,20,22)/t9-/m0/s1