methyl (1R,4S)-2-(4-methylphenyl)sulfonyl-3-tributylstannyl-7-azabicyclo[2.2.1]heptane-7-carboxylate

Systemtic Name: methyl (1R,4S)-2-(4-methylphenyl)sulfonyl-3-tributylstannyl-7-azabicyclo[2.2.1]heptane-7-carboxylate Openeye Name: methyl (1R,4S)-2-(p-tolylsulfonyl)-3-tributylstannyl-7-azabicyclo[2.2.1]heptane-7-carboxylate CAS Name: (1R,4S)-2-(4-methylphenyl)sulfonyl-3-tributylstannyl-7-azabicyclo[2.2.1]heptane-7-carboxylic acid methyl ester IUPAC Name: methyl (1R,4S)-2-(4-methylphenyl)sulfonyl-3-tributylstannyl-7-azabicyclo[2.2.1]heptane-7-carboxylate Traditional Name: (1R,4S)-2-tosyl-3-tributylstannyl-7-azabicyclo[2.2.1]heptane-7-carboxylic acid methyl ester Formula: C27H45NO4SSn MolecularWeight: 598.4255

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)(CCCC)C1C2CCC(C1S(=O)(=O)C3=CC=C(C=C3)C)N2C(=O)OC

Isomeric SMILES

CCCC[Sn](CCCC)(CCCC)C1[C@@H]2CC[C@H](C1S(=O)(=O)C3=CC=C(C=C3)C)N2C(=O)OC

InChI

InChI=1S/C15H18NO4S.3C4H9.Sn/c1-10-3-6-12(7-4-10)21(18,19)14-9-11-5-8-13(14)16(11)15(17)20-2;3*1-3-4-2;/h3-4,6-7,9,11,13-14H,5,8H2,1-2H3;3*1,3-4H2,2H3;/t11-,13+,14?;;;;/m0..../s1