[1-methylsulfonyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]-2H-pyridin-1-ium-5-yl]methanamine

Systemtic Name: [1-methylsulfonyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]-2H-pyridin-1-ium-5-yl]methanamine Openeye Name: [1-methylsulfonyl-1-(4-tetralin-6-yloxyphenyl)-2H-pyridin-1-ium-5-yl]methanamine CAS Name: [1-methylsulfonyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]-2H-pyridin-1-ium-5-yl]methanamine IUPAC Name: [1-methylsulfonyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]-2H-pyridin-1-ium-5-yl]methanamine Traditional Name: [1-mesyl-1-(4-tetralin-6-yloxyphenyl)-2H-pyridin-1-ium-5-yl]methylamine Formula: C23H27N2O3S+ MolecularWeight: 411.53708

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[N+]1(CC=CC(=C1)CN)C2=CC=C(C=C2)OC3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CS(=O)(=O)[N+]1(CC=CC(=C1)CN)C2=CC=C(C=C2)OC3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C23H27N2O3S/c1-29(26,27)25(14-4-5-18(16-24)17-25)21-9-12-22(13-10-21)28-23-11-8-19-6-2-3-7-20(19)15-23/h4-5,8-13,15,17H,2-3,6-7,14,16,24H2,1H3/q+1