lithium 4-[4-[(3-bromophenyl)methoxy]phenyl]-4-oxidanyl-butanoate

Systemtic Name: lithium 4-[4-[(3-bromophenyl)methoxy]phenyl]-4-oxidanyl-butanoate Openeye Name: lithium 4-[4-[(3-bromophenyl)methoxy]phenyl]-4-hydroxy-butanoate CAS Name: lithium 4-[4-[(3-bromophenyl)methoxy]phenyl]-4-hydroxybutanoate IUPAC Name: lithium 4-[4-[(3-bromophenyl)methoxy]phenyl]-4-hydroxybutanoate Traditional Name: lithium 4-[4-(3-bromobenzyl)oxyphenyl]-4-hydroxy-butyrate Formula: C17H16BrLiO4 MolecularWeight: 371.15154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[Li+].C1=CC(=CC(=C1)Br)COC2=CC=C(C=C2)C(CCC(=O)[O-])O

Isomeric SMILES

[Li+].C1=CC(=CC(=C1)Br)COC2=CC=C(C=C2)C(CCC(=O)[O-])O

InChI

InChI=1S/C17H17BrO4.Li/c18-14-3-1-2-12(10-14)11-22-15-6-4-13(5-7-15)16(19)8-9-17(20)21;/h1-7,10,16,19H,8-9,11H2,(H,20,21);/q;+1/p-1