[2-(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)-2-oxidanyl-ethyl]-[2-(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)ethyl]azanium chloride

Systemtic Name: [2-(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)-2-oxidanyl-ethyl]-[2-(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)ethyl]azanium chloride Openeye Name: [2-hydroxy-2-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)ethyl]-[2-(2-oxo-3H-1,3-benzoxazol-6-yl)ethyl]ammonium chloride CAS Name: [2-hydroxy-2-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)ethyl]-[2-(2-oxo-3H-1,3-benzoxazol-6-yl)ethyl]ammonium chloride IUPAC Name: [2-hydroxy-2-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)ethyl]-[2-(2-oxo-3H-1,3-benzoxazol-6-yl)ethyl]azanium chloride Traditional Name: [2-hydroxy-2-(2-keto-3-methyl-1,3-benzoxazol-6-yl)ethyl]-[2-(2-keto-3H-1,3-benzoxazol-6-yl)ethyl]ammonium chloride Formula: C19H20ClN3O5 MolecularWeight: 405.8322

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(C[NH2+]CCC3=CC4=C(C=C3)NC(=O)O4)O)OC1=O.[Cl-]

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(C[NH2+]CCC3=CC4=C(C=C3)NC(=O)O4)O)OC1=O.[Cl-]

InChI

InChI=1S/C19H19N3O5.ClH/c1-22-14-5-3-12(9-17(14)27-19(22)25)15(23)10-20-7-6-11-2-4-13-16(8-11)26-18(24)21-13;/h2-5,8-9,15,20,23H,6-7,10H2,1H3,(H,21,24);1H