butyl-bis(2-methylpropyl)-[(E)-1-phenylsulfanylhex-1-enyl]alumanuide

Systemtic Name: butyl-bis(2-methylpropyl)-[(E)-1-phenylsulfanylhex-1-enyl]alumanuide Openeye Name: butyl-diisobutyl-[(E)-1-phenylsulfanylhex-1-enyl]alumanuide CAS Name: butyl-bis(2-methylpropyl)-[(E)-1-(phenylthio)hex-1-enyl]alumanuide IUPAC Name: butyl-bis(2-methylpropyl)-[(E)-1-phenylsulfanylhex-1-enyl]alumanuide Traditional Name: butyl-diisobutyl-[(E)-1-(phenylthio)hex-1-enyl]alumanuide Formula: C24H42AlS- MolecularWeight: 389.636818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC=C([Al-](CCCC)(CC(C)C)CC(C)C)SC1=CC=CC=C1

Isomeric SMILES

CCCC/C=C(\[Al-](CCCC)(CC(C)C)CC(C)C)/SC1=CC=CC=C1

InChI

InChI=1S/C12H15S.3C4H9.Al/c1-2-3-4-8-11-13-12-9-6-5-7-10-12;2*1-4(2)3;1-3-4-2;/h5-10H,2-4H2,1H3;2*4H,1H2,2-3H3;1,3-4H2,2H3;/q;;;;-1