(2R)-2-[(2R)-3-oxidanylidene-2-phenyl-6-propanoyl-1,4-benzoxazin-4-yl]propanoate

Systemtic Name: (2R)-2-[(2R)-3-oxidanylidene-2-phenyl-6-propanoyl-1,4-benzoxazin-4-yl]propanoate Openeye Name: (2R)-2-[(2R)-3-oxo-2-phenyl-6-propanoyl-1,4-benzoxazin-4-yl]propanoate CAS Name: (2R)-2-[(2R)-3-oxo-6-(1-oxopropyl)-2-phenyl-1,4-benzoxazin-4-yl]propanoate IUPAC Name: (2R)-2-[(2R)-3-oxo-2-phenyl-6-propanoyl-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2R)-2-[(2R)-3-keto-2-phenyl-6-propionyl-1,4-benzoxazin-4-yl]propionate Formula: C20H18NO5- MolecularWeight: 352.36062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2C(C)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2[C@H](C)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H19NO5/c1-3-16(22)14-9-10-17-15(11-14)21(12(2)20(24)25)19(23)18(26-17)13-7-5-4-6-8-13/h4-12,18H,3H2,1-2H3,(H,24,25)/p-1/t12-,18-/m1/s1