[4-[2-(4-acetyloxyphenyl)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]phenyl] ethanoate; ethanoic acid

Systemtic Name: [4-[2-(4-acetyloxyphenyl)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]phenyl] ethanoate; ethanoic acid Openeye Name: acetic acid; [4-[2-(4-acetoxyphenyl)-3-oxo-4H-1,4-benzoxazin-2-yl]phenyl] acetate CAS Name: acetic acid; acetic acid [4-[2-(4-acetyloxyphenyl)-3-oxo-4H-1,4-benzoxazin-2-yl]phenyl] ester IUPAC Name: acetic acid; [4-[2-(4-acetyloxyphenyl)-3-oxo-4H-1,4-benzoxazin-2-yl]phenyl] acetate Traditional Name: acetic acid; acetic acid [4-[2-(4-acetoxyphenyl)-3-keto-4H-1,4-benzoxazin-2-yl]phenyl] ester Formula: C28H27NO10 MolecularWeight: 537.51468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CC(=O)O.CC(=O)OC1=CC=C(C=C1)C2(C(=O)NC3=CC=CC=C3O2)C4=CC=C(C=C4)OC(=O)C

Isomeric SMILES

CC(=O)O.CC(=O)O.CC(=O)OC1=CC=C(C=C1)C2(C(=O)NC3=CC=CC=C3O2)C4=CC=C(C=C4)OC(=O)C

InChI

InChI=1S/C24H19NO6.2C2H4O2/c1-15(26)29-19-11-7-17(8-12-19)24(18-9-13-20(14-10-18)30-16(2)27)23(28)25-21-5-3-4-6-22(21)31-24;2*1-2(3)4/h3-14H,1-2H3,(H,25,28);2*1H3,(H,3,4)