7-butyl-3-(2,5-dimethoxyphenyl)sulfonyl-9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane

Systemtic Name: 7-butyl-3-(2,5-dimethoxyphenyl)sulfonyl-9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane Openeye Name: 7-butyl-3-(2,5-dimethoxyphenyl)sulfonyl-9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane CAS Name: 7-butyl-3-(2,5-dimethoxyphenyl)sulfonyl-9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane IUPAC Name: 7-butyl-3-(2,5-dimethoxyphenyl)sulfonyl-9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane Traditional Name: 7-butyl-3-(2,5-dimethoxyphenyl)sulfonyl-9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane Formula: C21H34N2O4S MolecularWeight: 410.57066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC2CN(CC(C1)C2(C)C)S(=O)(=O)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCCCN1CC2CN(CC(C1)C2(C)C)S(=O)(=O)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H34N2O4S/c1-6-7-10-22-12-16-14-23(15-17(13-22)21(16,2)3)28(24,25)20-11-18(26-4)8-9-19(20)27-5/h8-9,11,16-17H,6-7,10,12-15H2,1-5H3