3-[(2R)-6-ethanoyl-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl]propanoic acid

Systemtic Name: 3-[(2R)-6-ethanoyl-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl]propanoic acid Openeye Name: 3-[(2R)-6-acetyl-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]propanoic acid CAS Name: 3-[(2R)-6-acetyl-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]propanoic acid IUPAC Name: 3-[(2R)-6-acetyl-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]propanoic acid Traditional Name: 3-[(2R)-6-acetyl-3-keto-2-phenyl-1,4-benzoxazin-4-yl]propionic acid Formula: C19H17NO5 MolecularWeight: 339.34198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C19H17NO5/c1-12(21)14-7-8-16-15(11-14)20(10-9-17(22)23)19(24)18(25-16)13-5-3-2-4-6-13/h2-8,11,18H,9-10H2,1H3,(H,22,23)/t18-/m1/s1