bis[2-(4-chloranyl-3-phenylsulfanyl-phenyl)but-3-enoyloxy]alumanylium hydroxide

Systemtic Name: bis[2-(4-chloranyl-3-phenylsulfanyl-phenyl)but-3-enoyloxy]alumanylium hydroxide Openeye Name: bis[2-(4-chloro-3-phenylsulfanyl-phenyl)but-3-enoyloxy]alumanylium hydroxide CAS Name: bis[2-[4-chloro-3-(phenylthio)phenyl]-1-oxobut-3-enoxy]alumanylium hydroxide IUPAC Name: bis[2-(4-chloro-3-phenylsulfanylphenyl)but-3-enoyloxy]alumanylium hydroxide Traditional Name: bis[2-[4-chloro-3-(phenylthio)phenyl]but-3-enoyloxy]alumanylium hydroxide Formula: C32H25AlCl2O5S2 MolecularWeight: 651.555438

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C1=CC(=C(C=C1)Cl)SC2=CC=CC=C2)C(=O)O[Al+]OC(=O)C(C=C)C3=CC(=C(C=C3)Cl)SC4=CC=CC=C4.[OH-]

Isomeric SMILES

C=CC(C1=CC(=C(C=C1)Cl)SC2=CC=CC=C2)C(=O)O[Al+]OC(=O)C(C=C)C3=CC(=C(C=C3)Cl)SC4=CC=CC=C4.[OH-]

InChI

InChI=1S/2C16H13ClO2S.Al.H2O/c2*1-2-13(16(18)19)11-8-9-14(17)15(10-11)20-12-6-4-3-5-7-12;;/h2*2-10,13H,1H2,(H,18,19);;1H2/q;;+3;/p-3