4-[[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-7-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-7-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-7-yl]amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[(2R)-3-keto-2-methyl-4H-1,4-benzoxazin-7-yl]amino]butyric acid Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=C(C=C2)NC(=O)CCC(=O)O

Isomeric SMILES

C[C@@H]1C(=O)NC2=C(O1)C=C(C=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C13H14N2O5/c1-7-13(19)15-9-3-2-8(6-10(9)20-7)14-11(16)4-5-12(17)18/h2-3,6-7H,4-5H2,1H3,(H,14,16)(H,15,19)(H,17,18)/t7-/m1/s1