[1-(6-bromanyl-2-oxidanyl-naphthalen-1-yl)naphthalen-2-yl] 2,2-dimethylpropanoate

Systemtic Name: [1-(6-bromanyl-2-oxidanyl-naphthalen-1-yl)naphthalen-2-yl] 2,2-dimethylpropanoate Openeye Name: [1-(6-bromo-2-hydroxy-1-naphthyl)-2-naphthyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [1-(6-bromo-2-hydroxy-1-naphthalenyl)-2-naphthalenyl] ester IUPAC Name: [1-(6-bromo-2-hydroxynaphthalen-1-yl)naphthalen-2-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [1-(6-bromo-2-hydroxy-1-naphthyl)-2-naphthyl] ester Formula: C25H21BrO3 MolecularWeight: 449.33644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=C3C=CC(=C4)Br)O

Isomeric SMILES

CC(C)(C)C(=O)OC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=C3C=CC(=C4)Br)O

InChI

InChI=1S/C25H21BrO3/c1-25(2,3)24(28)29-21-13-9-15-6-4-5-7-18(15)23(21)22-19-11-10-17(26)14-16(19)8-12-20(22)27/h4-14,27H,1-3H3