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

Systemtic Name: tert-butyl (1R,4S)-2-(4-methylphenyl)sulfonyl-3-tributylstannyl-7-azabicyclo[2.2.1]heptane-7-carboxylate Openeye Name: tert-butyl (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 tert-butyl ester IUPAC Name: tert-butyl (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 tert-butyl ester Formula: C30H51NO4SSn MolecularWeight: 640.50524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24NO4S.3C4H9.Sn/c1-12-5-8-14(9-6-12)24(21,22)16-11-13-7-10-15(16)19(13)17(20)23-18(2,3)4;3*1-3-4-2;/h5-6,8-9,11,13,15-16H,7,10H2,1-4H3;3*1,3-4H2,2H3;/t13-,15+,16?;;;;/m0..../s1