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

Systemtic Name: 2-[(2R)-6-butanoyl-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl]ethanoic acid Openeye Name: 2-[(2R)-6-butanoyl-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetic acid CAS Name: 2-[(2R)-3-oxo-6-(1-oxobutyl)-2-phenyl-1,4-benzoxazin-4-yl]acetic acid IUPAC Name: 2-[(2R)-6-butanoyl-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetic acid Traditional Name: 2-[(2R)-6-butyryl-3-keto-2-phenyl-1,4-benzoxazin-4-yl]acetic acid Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C20H19NO5/c1-2-6-16(22)14-9-10-17-15(11-14)21(12-18(23)24)20(25)19(26-17)13-7-4-3-5-8-13/h3-5,7-11,19H,2,6,12H2,1H3,(H,23,24)/t19-/m1/s1