7,7-dimethyl-2-(4-methylphenyl)sulfonyl-5-(tributylstannylmethyl)-1,3,6,7a-tetrahydroisoindole-5-carbonitrile

Systemtic Name: 7,7-dimethyl-2-(4-methylphenyl)sulfonyl-5-(tributylstannylmethyl)-1,3,6,7a-tetrahydroisoindole-5-carbonitrile Openeye Name: 7,7-dimethyl-2-(p-tolylsulfonyl)-5-(tributylstannylmethyl)-1,3,6,7a-tetrahydroisoindole-5-carbonitrile CAS Name: 7,7-dimethyl-2-(4-methylphenyl)sulfonyl-5-(tributylstannylmethyl)-1,3,6,7a-tetrahydroisoindole-5-carbonitrile IUPAC Name: 7,7-dimethyl-2-(4-methylphenyl)sulfonyl-5-(tributylstannylmethyl)-1,3,6,7a-tetrahydroisoindole-5-carbonitrile Traditional Name: 7,7-dimethyl-2-tosyl-5-(tributylstannylmethyl)-1,3,6,7a-tetrahydroisoindole-5-carbonitrile Formula: C31H50N2O2SSn MolecularWeight: 633.5159

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)(CCCC)CC1(CC(C2CN(CC2=C1)S(=O)(=O)C3=CC=C(C=C3)C)(C)C)C#N

Isomeric SMILES

CCCC[Sn](CCCC)(CCCC)CC1(CC(C2CN(CC2=C1)S(=O)(=O)C3=CC=C(C=C3)C)(C)C)C#N

InChI

InChI=1S/C19H23N2O2S.3C4H9.Sn/c1-14-5-7-16(8-6-14)24(22,23)21-10-15-9-19(4,13-20)12-18(2,3)17(15)11-21;3*1-3-4-2;/h5-9,17H,4,10-12H2,1-3H3;3*1,3-4H2,2H3;