[[(1R)-2-[2-(1,3-benzothiazol-5-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl-methyl-amino]methanesulfonate

Systemtic Name: [[(1R)-2-[2-(1,3-benzothiazol-5-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl-methyl-amino]methanesulfonate Openeye Name: [[(1R)-2-[2-(1,3-benzothiazol-5-yl)ethyl]-5-methoxy-tetralin-1-yl]methyl-methyl-amino]methanesulfonate CAS Name: [[(1R)-2-[2-(1,3-benzothiazol-5-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl-methylamino]methanesulfonate IUPAC Name: [[(1R)-2-[2-(1,3-benzothiazol-5-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl-methylamino]methanesulfonate Traditional Name: [[(1R)-2-[2-(1,3-benzothiazol-5-yl)ethyl]-5-methoxy-tetralin-1-yl]methyl-methyl-amino]methanesulfonate Formula: C23H27N2O4S2- MolecularWeight: 459.60148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1C(CCC2=C1C=CC=C2OC)CCC3=CC4=C(C=C3)SC=N4)CS(=O)(=O)[O-]

Isomeric SMILES

CN(C[C@@H]1C(CCC2=C1C=CC=C2OC)CCC3=CC4=C(C=C3)SC=N4)CS(=O)(=O)[O-]

InChI

InChI=1S/C23H28N2O4S2/c1-25(15-31(26,27)28)13-20-17(9-10-19-18(20)4-3-5-22(19)29-2)8-6-16-7-11-23-21(12-16)24-14-30-23/h3-5,7,11-12,14,17,20H,6,8-10,13,15H2,1-2H3,(H,26,27,28)/p-1/t17?,20-/m1/s1