[4-oxidanyl-2-(2-oxidanylidenepropyl)naphthalen-1-yl] 4-bromanylbenzoate

Systemtic Name: [4-oxidanyl-2-(2-oxidanylidenepropyl)naphthalen-1-yl] 4-bromanylbenzoate Openeye Name: (2-acetonyl-4-hydroxy-1-naphthyl) 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-hydroxy-2-(2-oxopropyl)-1-naphthalenyl] ester IUPAC Name: [4-hydroxy-2-(2-oxopropyl)naphthalen-1-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid (2-acetonyl-4-hydroxy-1-naphthyl) ester Formula: C20H15BrO4 MolecularWeight: 399.2347

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(C2=CC=CC=C2C(=C1)O)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)CC1=C(C2=CC=CC=C2C(=C1)O)OC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H15BrO4/c1-12(22)10-14-11-18(23)16-4-2-3-5-17(16)19(14)25-20(24)13-6-8-15(21)9-7-13/h2-9,11,23H,10H2,1H3