3-[3-oxidanylidene-6-(2-oxidanylidene-2-phenylmethoxy-ethyl)-1,4-benzoxazin-4-yl]propanoic acid

Systemtic Name: 3-[3-oxidanylidene-6-(2-oxidanylidene-2-phenylmethoxy-ethyl)-1,4-benzoxazin-4-yl]propanoic acid Openeye Name: 3-[6-(2-benzyloxy-2-oxo-ethyl)-3-oxo-1,4-benzoxazin-4-yl]propanoic acid CAS Name: 3-[3-oxo-6-(2-oxo-2-phenylmethoxyethyl)-1,4-benzoxazin-4-yl]propanoic acid IUPAC Name: 3-[3-oxo-6-(2-oxo-2-phenylmethoxyethyl)-1,4-benzoxazin-4-yl]propanoic acid Traditional Name: 3-[6-(2-benzoxy-2-keto-ethyl)-3-keto-1,4-benzoxazin-4-yl]propionic acid Formula: C20H19NO6 MolecularWeight: 369.36796

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)CC(=O)OCC3=CC=CC=C3)CCC(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)CC(=O)OCC3=CC=CC=C3)CCC(=O)O

InChI

InChI=1S/C20H19NO6/c22-18-13-26-17-7-6-15(10-16(17)21(18)9-8-19(23)24)11-20(25)27-12-14-4-2-1-3-5-14/h1-7,10H,8-9,11-13H2,(H,23,24)