dibutyltin; 2-[3-oxidanyl-4-(phenylcarbonyl)phenoxy]ethanoic acid

Systemtic Name: dibutyltin; 2-[3-oxidanyl-4-(phenylcarbonyl)phenoxy]ethanoic acid Openeye Name: 2-(4-benzoyl-3-hydroxy-phenoxy)acetic acid; dibutyltin CAS Name: 2-(4-benzoyl-3-hydroxyphenoxy)acetic acid; dibutyltin IUPAC Name: 2-(4-benzoyl-3-hydroxyphenoxy)acetic acid; dibutyltin Traditional Name: 2-(4-benzoyl-3-hydroxy-phenoxy)acetic acid; dibutyltin Formula: C38H42O10Sn MolecularWeight: 777.44408

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn]CCCC.C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCC(=O)O)O.C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCC(=O)O)O

Isomeric SMILES

CCCC[Sn]CCCC.C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCC(=O)O)O.C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCC(=O)O)O

InChI

InChI=1S/2C15H12O5.2C4H9.Sn/c2*16-13-8-11(20-9-14(17)18)6-7-12(13)15(19)10-4-2-1-3-5-10;2*1-3-4-2;/h2*1-8,16H,9H2,(H,17,18);2*1,3-4H2,2H3;