2-(8-methoxy-1-methyl-3,4-dihydro-2H-naphthalen-1-yl)piperazine; 4-methylbenzenesulfonate

Systemtic Name: 2-(8-methoxy-1-methyl-3,4-dihydro-2H-naphthalen-1-yl)piperazine; 4-methylbenzenesulfonate Openeye Name: 2-(8-methoxy-1-methyl-tetralin-1-yl)piperazine; 4-methylbenzenesulfonate CAS Name: 2-(8-methoxy-1-methyl-3,4-dihydro-2H-naphthalen-1-yl)piperazine; 4-methylbenzenesulfonate IUPAC Name: 2-(8-methoxy-1-methyl-3,4-dihydro-2H-naphthalen-1-yl)piperazine; 4-methylbenzenesulfonate Traditional Name: 2-(8-methoxy-1-methyl-tetralin-1-yl)piperazine tosylate Formula: C23H31N2O4S- MolecularWeight: 431.56824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1(CCCC2=C1C(=CC=C2)OC)C3CNCCN3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1(CCCC2=C1C(=CC=C2)OC)C3CNCCN3

InChI

InChI=1S/C16H24N2O.C7H8O3S/c1-16(14-11-17-9-10-18-14)8-4-6-12-5-3-7-13(19-2)15(12)16;1-6-2-4-7(5-3-6)11(8,9)10/h3,5,7,14,17-18H,4,6,8-11H2,1-2H3;2-5H,1H3,(H,8,9,10)/p-1