benzene; dodecyl sulfate; tricyclohexyltin; hydrate

Systemtic Name: benzene; dodecyl sulfate; tricyclohexyltin; hydrate Openeye Name: benzene; dodecyl sulfate; tricyclohexyltin; hydrate CAS Name: benzene; dodecyl sulfate; tricyclohexyltin; hydrate IUPAC Name: benzene; dodecyl sulfate; tricyclohexyltin; hydrate Traditional Name: benzene; lauryl sulfate; tricyclohexyltin; hydrate Formula: C36H66O5SSn- MolecularWeight: 729.68124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOS(=O)(=O)[O-].C1CCC(CC1)[Sn](C2CCCCC2)C3CCCCC3.C1=CC=CC=C1.O

Isomeric SMILES

CCCCCCCCCCCCOS(=O)(=O)[O-].C1CCC(CC1)[Sn](C2CCCCC2)C3CCCCC3.C1=CC=CC=C1.O

InChI

InChI=1S/C12H26O4S.3C6H11.C6H6.H2O.Sn/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;4*1-2-4-6-5-3-1;;/h2-12H2,1H3,(H,13,14,15);3*1H,2-6H2;1-6H;1H2;/p-1