3-[7-(dimethylamino)-2-oxidanylidene-1,4-benzoxazin-3-yl]propanoic acid

Systemtic Name: 3-[7-(dimethylamino)-2-oxidanylidene-1,4-benzoxazin-3-yl]propanoic acid Openeye Name: 3-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]propanoic acid CAS Name: 3-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]propanoic acid IUPAC Name: 3-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]propanoic acid Traditional Name: 3-[7-(dimethylamino)-2-keto-1,4-benzoxazin-3-yl]propionic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)N=C(C(=O)O2)CCC(=O)O

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)N=C(C(=O)O2)CCC(=O)O

InChI

InChI=1S/C13H14N2O4/c1-15(2)8-3-4-9-11(7-8)19-13(18)10(14-9)5-6-12(16)17/h3-4,7H,5-6H2,1-2H3,(H,16,17)