4-propan-2-ylbenzoic acid; triphenyltin

Systemtic Name: 4-propan-2-ylbenzoic acid; triphenyltin Openeye Name: 4-isopropylbenzoic acid; triphenyltin CAS Name: 4-propan-2-ylbenzoic acid; triphenyltin IUPAC Name: 4-propan-2-ylbenzoic acid; triphenyltin Traditional Name: cumic acid; triphenyltin Formula: C28H27O2Sn MolecularWeight: 514.22278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)O.C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)O.C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C10H12O2.3C6H5.Sn/c1-7(2)8-3-5-9(6-4-8)10(11)12;3*1-2-4-6-5-3-1;/h3-7H,1-2H3,(H,11,12);3*1-5H;