N-(4-bromophenyl)-2-(5-methyl-1-oxidanyl-9-oxidanylidene-xanthen-3-yl)oxy-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-(5-methyl-1-oxidanyl-9-oxidanylidene-xanthen-3-yl)oxy-ethanamide Openeye Name: N-(4-bromophenyl)-2-(1-hydroxy-5-methyl-9-oxo-xanthen-3-yl)oxy-acetamide CAS Name: N-(4-bromophenyl)-2-[(1-hydroxy-5-methyl-9-oxo-3-xanthenyl)oxy]acetamide IUPAC Name: N-(4-bromophenyl)-2-(1-hydroxy-5-methyl-9-oxoxanthen-3-yl)oxyacetamide Traditional Name: N-(4-bromophenyl)-2-(1-hydroxy-9-keto-5-methyl-xanthen-3-yl)oxy-acetamide Formula: C22H16BrNO5 MolecularWeight: 454.27014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC3=CC(=CC(=C3C2=O)O)OCC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC2=C1OC3=CC(=CC(=C3C2=O)O)OCC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H16BrNO5/c1-12-3-2-4-16-21(27)20-17(25)9-15(10-18(20)29-22(12)16)28-11-19(26)24-14-7-5-13(23)6-8-14/h2-10,25H,11H2,1H3,(H,24,26)